master_cpd_id	cpd_name	broad_cpd_id	top_test_conc_umol	cpd_status	inclusion_rationale	gene_symbol_of_protein_target	target_or_activity_of_compound	source_name	source_catalog_id	cpd_smiles
1788	CIL55	BRD-K46556387	1.00E+01	probe	pilot-set		screening hit	Columbia University		CN(C)CCNC(=O)c1cc2CSc3cc(Cl)ccc3-c2s1
3588	BRD4132	BRD-K86574132	1.60E+02	probe	chromatin;pilot-set		screening hit	ChemDiv Inc.	4998-1380	CC(C)N1C(=O)S\C(=C\c2ccc(Sc3nc4ccccc4[nH]3)o2)C1=O
12877	BRD6340	BRD-K35716340	3.30E+01	probe	chromatin;pilot-set		screening hit	ChemDiv Inc.	1988-0090	C(Cn1c2ccccc2c2ccccc12)c1nc2ccccc2[nH]1
17712	ML006	BRD-K89692698	5.30E+02	probe	pilot-set	S1PR3	agonist of sphingosine 1-phosphate receptor 3	Enamine Ltd.	Z1037336336	C1CN(CCO1)c1nnc(-c2ccccc2)c(n1)-c1ccccc1
18311	Bax channel blocker	BRD-A18763547	3.30E+01	probe	pilot-set	BAX	inhibitor of BAX-mediated mitochondrial cytochrome c release	Maybridge	RJC01737	OC(CN1CCNCC1)Cn1c2ccc(Br)cc2c2cc(Br)ccc12
19153	BRD9876	BRD-K89329876	1.30E+02	probe	pilot-set		screening hit	Sigma-Aldrich	425265	CC(C)(C)c1ccc2cc(C#N)c(cc2c1)C#N
23151	tretinoin	BRD-K64634304	1.30E+02	FDA	chromatin;pilot-set	RARA;RARB;RARG	agonist of retinoid acid receptors	Sigma-Aldrich;Sigma-Aldrich	R2625;R2625-50MG	CC(=CC=CC(=CC(=O)O)C)C=CC1=C(C)CCCC1(C)C
23256	betulinic acid	BRD-K45401373	6.60E+01	probe	chromatin;lit-search		natural product; inhibitor of specificity protein 1 transcription factor in cells	Tocris Bioscience	3906	CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12)C(O)=O
24173	phloretin	BRD-K15563106	5.90E+02	probe	pilot-set	SLC5A1	natural product; inhibitor of glucose uptake	Sigma-Aldrich	P7912	Oc1ccc(CCC(=O)c2c(O)cc(O)cc2O)cc1
24197	thalidomide	BRD-A93255169	6.60E+01	FDA	CTEP;kinome	CRBN	immunomodulatory drug; binder of cereblon	Selleck	S1193	O=C1N(C2CCC(=O)NC2=O)C(=O)c2ccccc12
25036	gossypol	BRD-K19295594	3.70E+01	clinical	CTEP;pilot-set	BCL2;BCL2L1;LDHA;LDHB;LDHC	inhibitor of lactate dehydrogenase; inhibitor of BCL2 family members	ChemDiv Inc.;Sigma-Aldrich	N010-0015;G8761	CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O
25334	chlorambucil	BRD-K29458283	2.70E+02	FDA	std-of-care		DNA alkylator	Sigma-Aldrich	C0253	OC(=O)CCCc1ccc(cc1)N(CCCl)CCCl
25344	fluorouracil	BRD-K24844714	1.30E+02	FDA	std-of-care	TYMS	pyrimidine analog; inhibitor of thymidylate synthase	Selleck	S1209	Fc1c[nH]c(=O)[nH]c1=O
25393	isoliquiritigenin	BRD-K33583600	3.30E+01	probe	pilot-set		natural product	MicroSource Discovery Systems Inc.	01504200	Oc1ccc(cc1)\C=C\C(=O)c1ccc(O)cc1O
26870	cimetidine	BRD-K34157611	2.70E+02	FDA	lit-search	HRH2	inhibitor of histidine receptor H2	Tocris Bioscience	0902	CN\C(NCCSCc1nc[nH]c1C)=N/C#N
26874	azacitidine	BRD-K03406345	6.60E+01	FDA	CTEP;std-of-care	DNMT1	inhibitor of DNA methyltransferase	Selleck	S1782	Nc1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1
26914	trifluoperazine	BRD-K89732114	3.30E+01	FDA	pilot-set	DRD2	antagonist of dopamine receptor D2	Toronto Research Chemicals	T779200	CN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
26956	paclitaxel	BRD-A28746609	6.60E+01	FDA	std-of-care		inhibitor of microtubule assembly	Selleck	S1150	CC(=O)O[C@@H]1C2=C(C)[C@H](C[C@@](O)([C@@H](OC(=O)c3ccccc3)C3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C1=O)OC(C)=O)C2(C)C)OC(=O)[C@H](O)[C@@H](NC(=O)c1ccccc1)c1ccccc1
26972	tamoxifen	BRD-K93754473	1.00E+02	FDA	chromatin;std-of-care	ESR1;ESR2	modulator of estrogen receptors	Sigma-Aldrich	T5648	CC\C(c1ccccc1)=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1
26979	carboplatin	BRD-K11626735	6.60E+01	FDA	std-of-care		inducer of DNA damage	Selleck	S1215	O=C1O[Pt]OC(=O)C11CCC1
27871	teniposide	BRD-A35588707	3.30E+01	FDA	pilot-set	TOP2A;TOP2B	inhibitor of topoisomerase II	MicroSource Discovery Systems Inc.	01504094	COc1cc(cc(OC)c1O)[C@H]1[C@@H]2C(COC2=O)C(O[C@@H]2O[C@@H]3CO[C@H](OC3[C@H](O)[C@H]2O)c2cccs2)c2cc3OCOc3cc12
27872	sildenafil	BRD-K50128260	5.30E+02	FDA	pilot-set	PDE5A	inhibitor of phosphodiesterase 5A	Toronto Research Chemicals	S435000	CCCc1nn(C)c2C(=O)NC(=Nc12)c3cc(ccc3OCC)S(=O)(=O)N4CCN(C)CC4
27894	simvastatin	BRD-K22134346	3.30E+01	FDA	pilot-set	HMGCR	inhibitor of HMG-CoA reductase	Tocris Bioscience	1965	CCC(C)(C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@@H]12
28172	parbendazole	BRD-K02407574	6.60E+01	probe	pilot-set		inhibitor of microtubule assembly	Sigma-Aldrich	PH009945	CCCCc1ccc2[nH]c(NC(=O)OC)nc2c1
28183	procarbazine	BRD-K13032584	6.60E+01	FDA	std-of-care		inducer of DNA damage	Selleck	S1995	CNNCc1ccc(cc1)C(=O)NC(C)C
28452	curcumin	BRD-K74148702	1.70E+02	clinical	pilot-set		natural product; modulator of ROS; modulator of NF-kappa-B signaling	Cayman	81025	COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O
28784	ciclopirox	BRD-K13044802	6.60E+01	FDA	lit-search	RRM1	substituted pyridone antimycotic; inhibitor of the iron-dependent enzyme ribonucleotide reductase	Sigma-Aldrich	C0415	Cc1cc(C2CCCCC2)n(O)c(=O)c1
28801	epigallocatechin-3-monogallate	BRD-K55591206	3.00E+02	probe	pilot-set		natural product	Selleck	S2250	Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c1cc(O)c(O)c(O)c1
29985	myricetin	BRD-K43149758	6.60E+01	probe	lit-search		flavonoid antioxidant	Selleck	S2326	Oc1cc(O)c2c(c1)oc(-c1cc(O)c(O)c(O)c1)c(O)c2=O
30371	methotrexate	BRD-K59456551	6.60E+01	FDA	std-of-care	DHFR	inhibitor of dihydrofolate reductase	Selleck	S1210	CN(Cc1cnc2nc(N)nc(N)c2n1)c1ccc(cc1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
30620	lovastatin	BRD-A70155556	1.30E+02	FDA	pilot-set	HMGCR	inhibitor of HMG-CoA reductase	AnalytiCon Discovery GmbH	NP-001236	CCC(C)C(=O)OC1CC(C)C=C2C=CC(C)C(CCC(O)CC(O)CC(O)=O)C12
32372	valdecoxib	BRD-K12994359	6.00E+02	FDA	pilot-set	PTGS2	inhibitor of cyclooxygenase-2 (COX2)	Sigma-Aldrich;Sigma-Aldrich	PA0179;PZ0179	Cc1onc(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1
32620	cyclophosphamide	BRD-A09722536	1.30E+02	FDA	std-of-care		DNA alkylator	Sigma-Aldrich	C0768	ClCCN(CCCl)P1(=O)NCCCO1
32622	dacarbazine	BRD-K35520305	6.60E+01	FDA	std-of-care		DNA alkylator	Selleck	S1221	CN(C)\N=N\c1[nH]cnc1C(N)=O
32653	niclosamide	BRD-K35960502	3.30E+01	FDA	lit-search	STAT3	inhibitor of STAT3 signaling	Sigma-Aldrich	N3510	Oc1ccc(Cl)cc1C(=O)Nc1ccc(cc1Cl)[N+]([O-])=O
33166	prochlorperazine	BRD-K19352500	6.60E+01	FDA	lit-search	DRD2	inhibitor of dopamine receptor D2	Tocris Bioscience	3287	CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc23)CC1
35319	ifosfamide	BRD-A67097164	6.60E+01	FDA	std-of-care		DNA alkylator	Selleck	S1302	ClCCNP1(=O)OCCCN1CCCl
36599	doxorubicin	BRD-K92093830	6.60E+01	FDA	std-of-care	TOP2A	inhibitor of topoisomerase II	Selleck	S1208	COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO
37190	ouabain	BRD-K35708212	2.70E+02	probe	lit-search	ATP1A1;ATP1A2;ATP1A3;ATP1A4;ATP1B1;ATP1B2;ATP1B3;ATP1B4	cardiac glycoside; inhibitor of the Na+/K+-ATPase	Tocris Bioscience	1076	C[C@@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)[C@H]4[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)C2=CC(=O)OC2)[C@H](O)[C@H](O)[C@H]1O
37479	BRD9647	BRD-K05649647	3.30E+01	probe	pilot-set		screening hit	ChemBridge Corporation	7910659	COc1ccc(cc1)N(C(=O)c1ccccc1)S(=O)(=O)c1cc(OC)ccc1OC
39782	piperlongumine	BRD-K24132293	3.30E+01	probe	pilot-set		natural product; modulator of ROS levels	Broad Institute of MIT and Harvard		COc1cc(cc(OC)c1OC)\C=C\C(=O)N1CCC=CC1=O
42319	BRD-K26531177	BRD-K26531177	3.30E+02	probe	outreach		analog of the natural product piperlongumine	Broad Institute of MIT and Harvard		COc1cc(CCC(=O)N2CCC=CC2=O)cc(OC)c1OC
44503	NSC23766	BRD-A80213327	5.30E+02	probe	pilot-set	RAC1;TIAM1;TRIO	inhibitor of RAC1-GEF interaction; prevents Rac1 activation by Rac-specific guanine nucleotide exchange factors (GEFs) TrioN and Tiam1	Cayman	13196	CCN(CC)CCCC(C)Nc1nc(C)cc(Nc2ccc3nc(C)cc(N)c3c2)n1
44511	pyrazolanthrone	BRD-K01567962	6.60E+01	probe	kinome	MAPK10;MAPK8;MAPK9	inhibitor of Jun N-terminal kinase (JNK) 1/2/3	Selleck	S1460	O=C1c2ccccc2-c2n[nH]c3cccc1c23
44554	C6-ceramide	BRD-K08608874	6.60E+01	probe	lit-search	MAPK1;PPP2CA;UGCG	inhibitor of glucosylceramide synthase; activator of MAP kinase (ERK); stimulator of protein phosphatase 2A	Sigma-Aldrich	H6524	CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO)NC(=O)CCCCC
44580	topotecan	BRD-K55696337	6.60E+01	FDA	std-of-care	TOP1	inhibitor of topoisomerase I	Selleck	S1231	CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccc(O)c(CN(C)C)c4cc3Cn1c2=O
45093	N9-isopropylolomoucine	BRD-K71726959	4.00E+02	probe	chromatin;kinome;pilot-set	CCNB1;CDK1;CDK5;CDK5R1	inhibitor of CDK1/cyclin B and CDK5/p35 complexes	Enzo Life Sciences	ALX-270-397-M005	CC(C)n1cnc2c(NCc3ccccc3)nc(NCCO)nc12
46792	importazole	BRD-A02481876	2.00E+02	probe	pilot-set	KPNB1	inhibitor of importin	Vitas-M Laboratory Ltd.;EMD Biosciences	STK171852;401105	CC(Nc1nc(nc2ccccc12)N1CCCC1)c1ccccc1
48589	etoposide	BRD-K37798499	2.80E+01	FDA	pilot-set;std-of-care	TOP2A	inhibitor of topoisomerase II	Selleck	S1225	COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](O[C@@H]2O[C@@H]3CO[C@@H](C)O[C@H]3[C@H](O)[C@H]2O)c2cc3OCOc3cc12
50131	PRIMA-1	BRD-K15318909	1.70E+02	probe	pilot-set	TP53	re-activator of the pro-apoptotic activity of mutant p53	Tocris Bioscience	1862	OCC1(CO)N2CCC(CC2)C1=O
50134	tanespimycin	BRD-K81473043	3.30E+01	clinical	pilot-set	HSP90AA1	inhibitor of HSP90	Tocris Bioscience	1515	CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O
50140	blebbistatin	BRD-A75817871	1.30E+02	probe	pilot-set	MYH1;MYH2	inhibitor of myosin II ATPases	Cayman	13165	Cc1ccc2N=C3N(CCC3(O)C(=O)c2c1)c1ccccc1
50163	cytochalasin B	BRD-K26664453	3.30E+01	probe	pilot-set		inhibitor of actin polymerization	Sigma-Aldrich	C6762	C[C@H]1[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@]22OC(=O)\C=C\[C@H](O)CCC[C@@H](C)C\C=C\[C@H]2[C@H](O)C1=C
50715	NSC95397	BRD-K68143200	3.30E+01	probe	pilot-set	CDC25A;CDC25B;CDC25C	inhibitor of cell division cycle 25 phosphatase (CDC25)	Sigma-Aldrich	N1786	OCCSC1=C(SCCO)C(=O)c2ccccc2C1=O
50727	manumycin A	BRD-K78599730	3.00E+01	probe	pilot-set	FNTA;FNTB	inhibitor of RAS farnesyltransferase	Sigma-Aldrich	M6418	CCCC[C@@H](C)\C=C(C)\C=C(/C)C(=O)NC1=C[C@@](O)(\C=C\C=C\C=C\C(=O)NC2C(=O)CCC2=O)[C@@H]2O[C@@H]2C1=O
50732	mitomycin	BRD-K59670716	5.00E+01	FDA	pilot-set;std-of-care		DNA crosslinker	Sigma-Aldrich	M0440	CO[C@]12[C@H]3N[C@H]3CN1C1=C([C@H]2COC(N)=O)C(=O)C(N)=C(C)C1=O
50737	tacrolimus	BRD-K69608737	7.40E+01	FDA	pilot-set	PPP3CA;PPP3CB;PPP3CC;PPP3R1;PPP3R2	inhibitor of calcineurin	Selleck	S5003	CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C(/C)[C@H]1OC(=O)[C@@H]2CCCCN2C(=O)C(=O)[C@]2(O)O[C@@H]([C@H](C[C@H]2C)OC)[C@H](C[C@@H](C)C\C(C)=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]1C)OC
50747	pifithrin-alpha	BRD-K66874953	2.30E+02	probe	pilot-set		inhibitor of p53-dependent signaling	Cayman	13326	Cc1ccc(cc1)C(=O)Cn1c2CCCCc2sc1=N
50753	SB-431542	BRD-K67298865	6.60E+01	probe	kinome	TGFBR1	inhibitor of the transforming growth factor beta type 1 receptor	Selleck	S1067	NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccccn1)-c1ccc2OCOc2c1
50769	staurosporine	BRD-K17953061	3.30E+00	probe	lit-search		inhibitor of multiple kinases	Sigma-Aldrich;LC Laboratories	S4400;S-9300	CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
52123	SB-225002	BRD-K61323504	3.70E+01	probe	pilot-set	CXCR2	inhibitor of chemokine receptor 2	ChemDiv Inc.	K815-2000	Oc1cc(ccc1NC(=O)Nc1ccccc1Br)[N+]([O-])=O
52133	PD 153035	BRD-K26603252	3.30E+01	probe	kinome	EGFR	inhibitor of EGFR	Selleck	S1079	COc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OC
52430	cerulenin	BRD-K52075040	1.50E+02	probe	pilot-set	FASN;HMGCS1	inhibitor of fatty acid synthase; inhibitor of HMG-CoA synthase	Cayman	10005647	C\C=C\C\C=C\CCC(=O)[C@H]1O[C@H]1C(N)=O
52576	purmorphamine	BRD-K73397362	1.50E+02	probe	pilot-set	SMO	activator of smoothened receptor	Tocris Bioscience;Cayman	10009634;10009634	C1CCC(CC1)n1cnc2c(Nc3ccc(cc3)N3CCOCC3)nc(Oc3cccc4ccccc34)nc12
52582	GSK-3 inhibitor IX	BRD-K04923131	6.60E+01	probe	kinome		inhibitor of JAK/STAT signaling	Tocris Bioscience	3194	O\N=C1/C(Nc2ccccc12)=C1/C(=O)Nc2cc(Br)ccc12
52882	dasatinib	BRD-K49328571	6.60E+01	FDA	CTEP;kinome;std-of-care	EPHA2;KIT;LCK;SRC;YES1	inhibitor of SRC, YES1, EPHA2, c-KIT, and LCK	Selleck	S1021	Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
52926	gefitinib	BRD-K64052750	6.60E+01	FDA	chromatin;CTEP;kinome;std-of-care	AKT1;EGFR	inhibitor of EGFR and AKT1	Selleck	S1025	COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
52928	erlotinib	BRD-K70401845	6.60E+01	FDA	CTEP;kinome;std-of-care	EGFR;ERBB2	inhibitor of EGFR and HER2	Selleck	S1023	COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC
53556	BRD-K94991378	BRD-K94991378	8.30E+01	probe	DOS;outreach		inducer of ROS	Broad Institute of MIT and Harvard		COCCOC(=O)N1C(=O)[C@]2([C@@H]([C@@H]3N([C@@H]2c2ccccc2OCCO)[C@H]([C@H](OC3=O)c2ccccc2)c2ccccc2)C(=O)NCC=C)c2cc(ccc12)C#CCC(C(=O)OC)C(=O)OC
53705	BIX-01294	BRD-K26818574	3.30E+01	probe	chromatin;pilot-set	EHMT2	inhibitor of G9a histone methyltransferase	Broad Institute of MIT and Harvard		COc1cc2nc(nc(NC3CCN(Cc4ccccc4)CC3)c2cc1OC)N1CCCN(C)CC1
54200	tacedinaline	BRD-K52313696	3.30E+01	probe	chromatin;lit-search;outreach	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8	Stanley Center for Psychiatric Research at the Broad Institute		CC(=O)Nc1ccc(cc1)C(=O)Nc1ccccc1N
54210	LBH-589	BRD-K02130563	6.60E+01	clinical	chromatin;outreach	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8	Stanley Center for Psychiatric Research at the Broad Institute		Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1
55307	IC-87114	BRD-K75430629	6.60E+01	probe	kinome	PIK3CD	inhibitor of PI3K catalytic subunit delta	Selleck	S1268	Cc1ccccc1-n1c(Cn2cnc3c(N)ncnc23)nc2cccc(C)c2c1=O
55512	ciclosporin	BRD-A38030642	3.30E+01	FDA	pilot-set	PPID	inhibitor of calcineurin by binding to cyclophilin D	Tocris Bioscience	1101	CCC1NC(=O)C([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)C(C)NC(=O)C(CC(C)C)N(C)C(=O)C(NC(=O)C(CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C
56554	vorinostat	BRD-K81418486	3.30E+01	FDA	chromatin;CTEP;pilot-set;std-of-care	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8	Toronto Research Chemicals	S688700	ONC(=O)CCCCCCC(=O)Nc1ccccc1
56703	sirolimus	BRD-K84937637	3.30E+01	FDA	kinome	MTOR	inhibitor of mTOR	Selleck	S1039	CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O
58339	KU-55933	BRD-K25311561	6.60E+01	probe	kinome	ATM	inhibitor of ataxia telangiectasia mutated (ATM)	Selleck	S1092	O=c1cc(oc(c1)-c1cccc2Sc3ccccc3Sc12)N1CCOCC1
58442	sitagliptin	BRD-K19416115	6.60E+01	FDA	outreach	DPP4	inhibitor of dipetidyl peptidase-4	Selleck	S4002	N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1F
58455	AM-580	BRD-K06854232	5.30E+02	probe	chromatin;pilot-set	RARA	agonist of retinoic acid receptor alpha	Sigma-Aldrich	A8843	CC1(C)CCC(C)(C)c2cc(ccc12)C(=O)Nc1ccc(cc1)C(O)=O
58472	PDMP	BRD-K05653692	2.10E+02	probe	pilot-set	UGCG	inhibitor of ceramide glucosyltransferase	Enzo Life Sciences	BML-SL210	CCCCCCCCCC(=O)N[C@H](CN1CCOCC1)[C@H](O)c1ccccc1
58566	BRD-K71935468	BRD-K71935468	8.30E+01	probe	DOS;outreach		inducer of ROS	Broad Institute of MIT and Harvard		COC(=O)C(CC#Cc1ccc2NC(=O)[C@@]3([C@H]([C@H]4N([C@H]3c3ccccc3OCCO)[C@@H]([C@@H](OC4=O)c3ccccc3)c3ccccc3)C(=O)N3CCN(CC3)c3ncccn3)c2c1)C(=O)OC
58948	MG-132	BRD-K60230970	2.00E+01	probe	lit-search	PSMB1;PSMB2;PSMB5;PSMD1;PSMD2	inhibitor of the proteosome	Selleck;Broad Institute of MIT and Harvard	S2619	CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C=O
60218	entinostat	BRD-K77908580	6.60E+01	clinical	chromatin;CTEP;outreach	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8	Stanley Center for Psychiatric Research at the Broad Institute		Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)cc1
60225	belinostat	BRD-K17743125	6.60E+01	clinical	chromatin;CTEP	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8	Selleck	S1085	ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)Nc1ccccc1
60679	BEC	BRD-K53792571	2.70E+02	probe	pilot-set	ARG1;ARG2	inhibitor of arginase I and II	EMD Biosciences	197900	N[C@H](CSCCB(O)O)C(O)=O
61097	apicidin	BRD-K64606589	3.30E+01	probe	chromatin;outreach	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8	Fermentek Ltd	Fermentek-AC001	CC[C@@H](C)[C@@H]1NC(=O)[C@H](Cc2cn(OC)c3ccccc23)NC(=O)[C@H](CCCCCC(=O)CC)NC(=O)[C@H]2CCCCN2C1=O
61674	Merck60	BRD-K04466929	3.30E+01	probe	chromatin;pilot-set	HDAC1;HDAC2	inhibitor of HDAC1 and HDAC2	Stanley Center for Psychiatric Research at the Broad Institute		CC(=O)Nc1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1cccs1
61724	BRD-A94377914	BRD-A94377914	3.30E+01	probe	chromatin;outreach	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8	Stanley Center for Psychiatric Research at the Broad Institute		CN1CCCCC1NC(=O)[C@H](CCCCCC(C)=O)C(=O)Nc1nc(cs1)-c1ccccc1
61775	FGIN-1-27	BRD-K09778810	3.30E+01	probe	pilot-set	TSPO	activator of peripheral benzodiazepine receptor/translocator protein	Tocris Bioscience	0658	CCCCCCN(CCCCCC)C(=O)Cc1c([nH]c2ccccc12)-c1ccc(F)cc1
62111	compound 1B	BRD-A42556028	6.60E+01	probe	chromatin;outreach		screening hit	Enamine Ltd.	T0503-7331	CCN(CC)c1ccc(cc1[N+]([O-])=O)C1=NNC(=O)CC1C
62602	vincristine	BRD-K82109576	1.30E+02	FDA	std-of-care		inhibitor of mictrotubule assembly	Selleck	S1241	CC[C@]1(O)C[C@@H]2CN(C1)CCc1c([nH]c3ccccc13)[C@@](C2)(C(=O)OC)c1cc2c(cc1OC)N(C=O)[C@@H]1[C@]22CCN3CC=C[C@](CC)([C@@H]23)[C@@H](OC(C)=O)[C@]1(O)C(=O)OC
62690	cytarabine hydrochloride	BRD-K33106058	6.60E+01	FDA	std-of-care		inducer of DNA damage	Selleck	S1648	Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)n1
63349	itraconazole	BRD-A34817987	1.70E+01	FDA	pilot-set		anti-fungal agent; inhibitor of hedgehog signaling pathway	Sigma-Aldrich	I6657	CCC(C)n1ncn(-c2ccc(cc2)N2CCN(CC2)c2ccc(OCC3COC(Cn4cncn4)(O3)c3ccc(Cl)cc3Cl)cc2)c1=O
63578	erastin	BRD-A25004090	6.60E+01	probe	pilot-set	SLC7A11;VDAC1;VDAC2	modulator of voltage-dependent anion channels; inhibitor of solute carrier SLC7A11	Sigma-Aldrich	E7781	CCOc1ccccc1-n1c(=O)c2ccccc2nc1C(C)N1CCN(CC1)C(=O)COc1ccc(Cl)cc1
96171	ML031	BRD-K38985961	5.30E+02	probe	pilot-set	S1PR2	inhibitor of sphingosine 1-phosphate receptor 2	Enamine Ltd.	Z19746470	Cc1cc(C(=O)CN2C(=O)CCC2=O)c(C)n1Cc1ccccc1
100490	CIL56	BRD-K11740178	2.50E+00	probe	pilot-set		screening hit	Columbia University		ON=C1c2cc(ccc2-c2ccc(cc12)S(=O)(=O)N1CCCCC1)S(=O)(=O)N1CCCCC1
102193	FQI-1	BRD-A91658086	3.30E+01	probe	pilot-set		inhibitor of LSF1-mediated transcription	Boston University		CCOc1ccccc1C1CC(=O)Nc2cc3OCOc3cc12
119769	BRD-K92856060	BRD-K92856060	3.30E+01	probe	DOS;outreach		screening hit	ChemBridge Corporation	7653590	COc1ccc(cc1[N+]([O-])=O)S(=O)(=O)N(C(C)=O)c1ccc(OC(C)=O)c2ccccc12
122255	B02	BRD-K10882151	1.30E+02	probe	chromatin;pilot-set	RAD51	inhibitor of RAD51	Vitas-M Laboratory Ltd.	STK856883	O=c1n(Cc2ccccc2)c(\C=C\c2cccnc2)nc2ccccc12
142931	BRD-K45681478	BRD-K45681478	6.60E+01	probe	DOS;outreach		product of diversity oriented synthesis; screening hit	Broad Institute of MIT and Harvard		ClC1=C(NCC=C)C(=O)c2ccccc2C1=O
153820	ML050	BRD-A83255679	6.60E+01	probe	pilot-set	GPER1	antagonist of GPR30	Asinex Ltd.	BAS 02002358	Brc1cc2OCOc2cc1C1Nc2ccccc2C2C=CCC12
154846	ML162	BRD-A36275421	3.30E+01	probe	pilot-set		selectively kills engineered cells expressing mutant HRAS	ChemDiv Inc.	K784-3185	COc1ccc(cc1Cl)N(C(C(=O)NCCc1ccccc1)c1cccs1)C(=O)CCl
176181	CIL41	BRD-K05392795	1.60E+02	probe	pilot-set		screening hit	Columbia University		N=C(NOC(=O)C12CC3CC(CC(C3)C1)C2)c1ccccc1
182395	NSC30930	BRD-K29711668	6.60E+01	probe	outreach	SRD5A2	inhibitor of steroid 5-alpha reductase	National Cancer Institute Chemotherapeutic Agents Repository		OC(=O)c1cc2cc(OCc3ccccc3)ccc2[nH]1
183526	CIL70	BRD-K20215950	4.00E+01	probe	pilot-set		screening hit	Columbia University		Clc1ccc(CC(=N)NOC(=O)c2cccc3ccccc23)cc1
185987	MI-1	BRD-K64497429	3.30E+01	probe	lit-search	MEN1	binder of menin; inhibitor of menin-MLL fusion protein	InterBioScreen Ltd.	STOCK3S-35137	CC1(C)CN=C(S1)N1CCN(CC1)c1ncnc2sc3CCCCc3c12
199337	DBeQ	BRD-K59204667	6.60E+01	probe	lit-search	VCP	inhibitor of p97 in cells	Tocris Bioscience	4417	C(Nc1nc(NCc2ccccc2)c2ccccc2n1)c1ccccc1
215497	Mdivi-1	BRD-K61128465	6.60E+01	probe	lit-search	DNM1	inhibitor of dynamin 1; inhibitor of mitrochondrial division inhibitor	Tocris Bioscience	3982	COc1cc(c(Cl)cc1Cl)-n1c(=S)[nH]c2ccccc2c1=O
255961	ML083	BRD-K44241590	3.70E+01	probe	pilot-set	PKM	activator of muscle pyruvate kinase	Enamine Ltd.	T6096896	COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)S(=O)(=O)c1ccc2OCCOc2c1
267119	CID-5951923	BRD-A86956638	6.60E+01	probe	chromatin;lit-search	KLF5	modulator of KLF5 expression	Tocris Bioscience	4446	CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)\C=C\c1cccc(c1)[N+]([O-])=O
272805	IU1	BRD-K45841694	6.60E+01	probe	lit-search	USP14	inhibitor of the deubiquitinase activity of USP14	Tocris Bioscience	4088	Cc1cc(C(=O)CN2CCCC2)c(C)n1-c1ccc(F)cc1
277354	dexamethasone	BRD-A35108200	3.30E+01	FDA	pilot-set	NR3C1	agonist of glucocorticoid receptor	ChemDiv Inc.	R092-0055	CC1CC2C3CCC4=CC(=O)C=CC4(C)C3(F)C(O)CC2(C)C1(O)C(=O)CO
290356	ML311	BRD-A40802033	6.60E+01	probe	outreach	MCL1	inhibitor of MCL1	Eutropics Pharmaceuticals	EU-5346	CCN1CCN(CC1)C(c1ccc(cc1)C(F)(F)F)c1ccc2cccnc2c1O
340501	VX-680	BRD-K59369769	6.60E+01	clinical	pilot-set	AURKA;AURKB;AURKC	inhibitor of aurora kinases	Selleck	S1048	CN1CCN(CC1)c1cc(Nc2cc(C)[nH]n2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
345041	imatinib	BRD-K92723993	6.60E+01	FDA	std-of-care	ABL1;BCR;KIT	inhibitor of BCR-ABL1 and c-KIT	Selleck	S2475	CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
345712	O-6-benzylguanine	BRD-K92041145	6.60E+01	clinical	CTEP	MGMT	inhibitor of O(6)-alkylguanine DNA alkyltransferases	Sigma-Aldrich	B2292	Nc1nc(OCc2ccccc2)c2[nH]cnc2n1
347775	decitabine	BRD-K79254416	6.60E+01	FDA	chromatin;CTEP;std-of-care	DNMT1	inhibitor of DNA methyltransferase	Selleck	S1200	Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
347812	CHIR-99021	BRD-K16189898	8.00E+01	probe	kinome;pilot-set	GSK3B	inhibitor of GSK3 beta	Selleck	S1263	Cc1c[nH]c(n1)-c1cnc(NCCNc2ccc(cn2)C#N)nc1-c1ccc(Cl)cc1Cl
347813	BI-2536	BRD-K64890080	3.30E+01	clinical	kinome;pilot-set	PLK1	inhibitor of polo-like kinase 1 (PLK1)	Selleck	S1109	CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O
348633	BRD-K61166597	BRD-K61166597	6.60E+01	probe	chromatin;outreach		inhibitor of HDAC1 and HDAC2	Stanley Center for Psychiatric Research at the Broad Institute		Nc1ccc(cc1NC(=O)c1ccc(cc1)C(=O)NCCc1ccncc1)-c1cccs1
348990	axitinib	BRD-K29905972	6.60E+01	FDA	kinome	FLT1;FLT3;KDR;KIT;PDGFRA;PDGFRB	inhibitor of VEGFRs, c-KIT, and PDGFR alpha and beta	Selleck	S1005	CNC(=O)c1ccccc1Sc1ccc2c(\C=C\c3ccccn3)n[nH]c2c1
348991	selumetinib	BRD-K57080016	2.70E+02	clinical	CTEP;kinome;pilot-set	MAP2K1;MAP2K2	inhibitor of MEK1 and MEK2	Selleck	S1008	Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
348992	NVP-BEZ235	BRD-K12184916	1.70E+01	clinical	kinome;outreach;pilot-set	MTOR;PIK3CA;PIK3CB;PIK3CD;PIK3CG	inhibitor of PI3K and mTOR kinase activity	Spanish National Cancer Research Centre		Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)-c1cnc2ccccc2c1
348997	GW-843682X	BRD-K90382497	3.30E+01	probe	kinome;pilot-set	PLK1;PLK3	inhibitor of PLK1 and PLK3	Axon Medchem	1131	COc1cc2ncn(-c3cc(OCc4ccccc4C(F)(F)F)c(s3)C(N)=O)c2cc1OC
349002	vandetanib	BRD-K77625799	6.60E+01	FDA	kinome;std-of-care	EGFR;KDR	inhibitor of VEGFR2 and EGFR	Selleck	S1046	COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
349006	sorafenib	BRD-K23984367	6.60E+01	FDA	CTEP;kinome;std-of-care	BRAF;FLT3;KDR;RAF1	inhibitor of BRAF, CRAF, and VEGFR2	Cayman	10009644	CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1
350548	ML029	BRD-K59962020	3.30E+01	probe	chromatin;pilot-set		inhibitor of antigen receptor-mediated NFkappaB activity	WuXi AppTec	TH02453-034	Cc1cc2nc(NCCCO)n(CC(=O)c3cc(c(O)c(c3)C(C)(C)C)C(C)(C)C)c2cc1C
351043	temozolomide	BRD-A94153989	6.60E+01	FDA	std-of-care		DNA alkylator	Selleck	S1237	CN1N=Nc2c(ncn2C1=O)C(=O)N
362063	QW-BI-011	BRD-K72264770	3.30E+01	probe	chromatin;pilot-set	EHMT2	inhibitor of G9a histone methyltransferase	Broad Institute of MIT and Harvard		COC(=O)c1ccc2n(CCCc3ccccc3)c(NC(=O)c3ccccc3)nc2c1
362207	BRD-K90370028	BRD-K90370028	3.30E+01	probe	outreach		screening hit	Broad Institute of MIT and Harvard		CC(=O)N[C@@H]1C\C=C\CCC(=O)N[C@@H](COC1=O)c1ccccc1
362338	SNX-2112	BRD-K71281111	3.70E+01	probe	pilot-set	HSP90AA1;HSP90B1	inhibitor of HSP90alpha and HSP90beta	Broad Institute of MIT and Harvard		CC1(C)Cc2c(c(nn2-c2ccc(C(N)=O)c(N[C@H]3CC[C@H](O)CC3)c2)C(F)(F)F)C(=O)C1
362342	navitoclax	BRD-K82746043	3.30E+01	clinical	CTEP;pilot-set	BCL2;BCL2L1;BCL2L2	inhibitor of BCL2, BCL-xL, and BCL-W	Selleck	S1001	CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
374747	bexarotene	BRD-K92441787	6.60E+01	FDA	chromatin;std-of-care	RXRA;RXRB;RXRG	inhibitor of retinoid X receptors	LC Laboratories	B-2422	Cc1cc2c(cc1C(=C)c1ccc(cc1)C(O)=O)C(C)(C)CCC2(C)C
374749	nilotinib	BRD-K81528515	6.60E+01	FDA	kinome;std-of-care	ABL1;BCR;KIT	inhibitor of ABL1, BCR, and c-KIT	Selleck	S1033	Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
374750	sunitinib	BRD-K42828737	6.60E+01	FDA	CTEP;kinome	FLT1;FLT3;KDR;KIT;PDGFRA;PDGFRB	inhibitor of VEGFRs, c-KIT, and PDGFR alpha and beta	Selleck	S1042	CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
374755	bendamustine	BRD-K17068645	6.60E+01	FDA	std-of-care		DNA alkylator	Selleck	S1212	Cn1c(CCCC(O)=O)nc2cc(ccc12)N(CCCl)CCCl
375219	omacetaxine mepesuccinate	BRD-K76674262	6.60E+01	FDA	lit-search		inhibitor of protein translation by preventing protein elongation	Tocris Bioscience	1416	COC(=O)C[C@](O)(CCCC(C)(C)O)C(=O)O[C@H]1[C@H]2c3cc4OCOc4cc3CCN3CCC[C@]23C=C1OC
375256	CD-437	BRD-K28907958	3.70E+01	probe	chromatin;pilot-set	RARG	agonist of retinoic acid receptor gamma	Sigma-Aldrich	C5865	OC(=O)c1ccc2cc(ccc2c1)-c1ccc(O)c(c1)C12CC3CC(CC(C3)C1)C2
375264	SCH-79797	BRD-K17140735	3.70E+01	probe	pilot-set	F2R	antagonist of proteinase-activated receptor 1 (PAR1)	Tocris Bioscience	1592	CC(C)c1ccc(Cn2ccc3c2ccc2nc(NC4CC4)nc(N)c32)cc1
375354	LE-135	BRD-K06593056	6.60E+01	probe	pilot-set	RARB	antagonist of retinoic acid receptor beta	Tocris Bioscience	2021	CN1c2cc3c(cc2N=C(c2ccc(cc2)C(O)=O)c2ccccc12)C(C)(C)CCC3(C)C
375366	SKI-II	BRD-K20755323	1.30E+02	probe	kinome;pilot-set	SPHK1	inhibitor of sphingosine kinase 1	Cayman	10009222	Oc1ccc(Nc2nc(cs2)-c2ccc(Cl)cc2)cc1
375390	CI-976	BRD-K88544581	2.70E+02	probe	pilot-set	ACAT1	inhibitor of acetyl-CoA acetyltransferase I	Sigma-Aldrich	C3743	CCCCCCCCCCC(C)(C)C(=O)Nc1c(OC)cc(OC)cc1OC
375395	Platin	BRD-K69172251	6.60E+01	FDA	std-of-care		DNA alkylator; organoplatinum reagent	Selleck	S1166	N[Pt](N)(Cl)Cl
375435	necrostatin-1	BRD-A36318220	5.30E+02	probe	pilot-set	RIPK1	inhibitor of receptor-interacting protein kinase 1; inhibitor of the necroptosis cell death pathway	Sigma-Aldrich	N9037	CN1C(=S)NC(Cc2c[nH]c3ccccc23)C1=O
375447	GW-405833	BRD-K10705233	1.30E+02	probe	pilot-set	CNR2	partial agonist of cannabinoid receptor 2	Sigma-Aldrich	G1421	COc1ccc2n(C(=O)c3cccc(Cl)c3Cl)c(C)c(CCN3CCOCC3)c2c1
375487	AC55649	BRD-K93176058	3.30E+01	probe	chromatin;pilot-set	RARB	agonist of retinoic acid receptor beta	ChemBridge Corporation	5308535	CCCCCCCCc1ccc(cc1)-c1ccc(cc1)C(O)=O
375492	RITA	BRD-K00317371	3.30E+01	probe	pilot-set	MDM2;TP53	inhibitor of p53-MDM2 interaction	Tocris Bioscience	2443	OCc1ccc(s1)-c1ccc(o1)-c1ccc(CO)s1
375496	LY-2183240	BRD-K37865504	3.30E+01	probe	pilot-set	FAAH	inhibitor of fatty acid amide hydrolase; inhibitor of anandamide uptake	Tocris Bioscience	2452	CN(C)C(=O)n1nnnc1Cc1ccc(cc1)-c1ccccc1
375560	Ki8751	BRD-K47150025	6.60E+01	probe	kinome	KDR;KIT;PDGFRA	inhibitor of VEGFR2, c-KIT, and PDGFRA	Selleck	S1363	COc1cc2nccc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)c(F)c3)c2cc1OC
375562	CD-1530	BRD-K25737009	1.30E+02	probe	chromatin;pilot-set	RARG	agonist of retinoic acid receptor gamma	Tocris Bioscience	2554	OC(=O)c1ccc(cc1)-c1ccc2cc(c(O)cc2c1)C12CC3CC(CC(C3)C1)C2
375564	TPCA-1	BRD-K51575138	6.60E+01	probe	chromatin;outreach	IKBKB	inhibitor of IKK-2	Tocris Bioscience	2559	NC(=O)Nc1sc(cc1C(N)=O)-c1ccc(F)cc1
375582	oxaliplatin	BRD-M14820059	6.60E+01	FDA	std-of-care		DNA alkylator; organoplatinum reagent	Selleck	S1224	O=C1O[Pt]2(NC3CCCCC3N2)OC1=O
375594	NSC632839	BRD-K37392901	3.30E+01	probe	pilot-set	USP13;USP5	inhibitor of ubiquitin isopeptidase			Cc1ccc(C=C2CNCC(=Cc3ccc(C)cc3)C2=O)cc1
375596	pifithrin-mu	BRD-K96799727	3.30E+01	probe	pilot-set	HSPA1A;HSPA1B;HSPA1L;TP53	inhibitor of p53 binding to mitochondria; inhibitor of HSP70	Sigma-Aldrich	P0122	NS(=O)(=O)C#Cc1ccccc1
375637	SN-38	BRD-A36630025	1.30E+00	probe	pilot-set	TOP1	metabolite of irinotecan; inhibitor of topoisomerase I	Tocris Bioscience	2684	CCc1c2Cn3c(cc4c(COC(=O)C4(O)CC)c3=O)-c2nc2ccc(O)cc12
376307	BRD-K80183349	BRD-K80183349	6.60E+01	probe	chromatin;outreach	HDAC1;HDAC2	inhibitor of HDAC1 and HDAC2	Stanley Center for Psychiatric Research at the Broad Institute		CC(=O)N1CCC(CC1)C(=O)Nc1cc(ccc1N)-c1cccs1
376693	BRD-K66532283	BRD-K66532283	6.60E+01	probe	chromatin;outreach	HDAC1;HDAC2	inhibitor of HDAC1 and HDAC2	Stanley Center for Psychiatric Research at the Broad Institute		Nc1ccc(cc1NC(=O)C1=CCCC1)-c1cccs1
377381	MK-2206	BRD-K68065987	3.30E+01	clinical	chromatin;CTEP;kinome;pilot-set	AKT1	inhibitor of AKT1	Selleck	S1078	NC1(CCC1)c1ccc(cc1)-c1nc2ccn3c(n[nH]c3=O)c2cc1-c1ccccc1
385240	triazolothiadiazine	BRD-K05402890	6.60E+01	probe	pilot-set	PDE4A;PDE4B;PDE4D	inhibitor of phosphdiesterase 4A/B/D	WuXi AppTec	TH02420-017	COc1ccc(OC)c(c1)-c1nnc2SCC(=Nn12)c1ccc(OC)c(OC)c1
387472	BRD-K66453893	BRD-K66453893	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)S(=O)(=O)c2ccc(Cl)cc2)Oc2ccc(NC(=O)CCC(F)(F)F)cc2CC1=O
389297	BRD-K11533227	BRD-K11533227	6.60E+01	probe	chromatin;outreach	HDAC1;HDAC2	inhibitor of HDAC1 and HDAC2	Stanley Center for Psychiatric Research at the Broad Institute		CC(=O)NC1CCN(CC1)C(=O)Nc1cc(ccc1N)-c1cccs1
397964	BRD-K27224038	BRD-K27224038	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)C2CCOCC2)Oc2ncc(cc2C1=O)C#CC1(O)CCCC1
401251	BRD-K33514849	BRD-K33514849	3.40E+01	probe	outreach		screening hit	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1
402775	BRD-K14844214	BRD-K14844214	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CC(C)CC#Cc1ccc2c(O[C@@H](CN(C)C(=O)c3cnccn3)[C@H](C)CN([C@H](C)CO)S2(=O)=O)c1
404070	BRD1835	BRD-K62801835	1.30E+02	probe	chromatin;DOS;outreach	EZH2	product of diversity oriented synthesis; screening hit	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2cc(ccc2S1(=O)=O)C#CCC1CCCC1
404452	BRD-K41597374	BRD-K41597374	6.70E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cc(F)ccc2F)Oc2cc(ccc2S1(=O)=O)C#CC1CCCC1
404566	BRD-K63431240	BRD-K63431240	6.60E+01	probe	DOS;outreach		product of diversity oriented synthesis; screening hit	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2ccc3OCOc3c2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccncc1
410270	BRD-K13999467	BRD-K13999467	6.70E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Cc2ccncc2)Oc2cc(ccc2S1(=O)=O)C#Cc1ccccc1F
410703	BRD-K96970199	BRD-K96970199	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C\C=C\c1ccc2c(O[C@@H](CN(C)C(=O)c3ccccc3)[C@@H](C)CN([C@@H](C)CO)S2(=O)=O)c1
411714	brefeldin A	BRD-A31107743	3.70E+01	probe	pilot-set	ARF1	modulator of ADP-ribosylation factor 1; inhibitor of protein translocation from ER to Golgi	ChemBridge Corporation	6908419	CC1CCC\C=C/C2CC(O)CC2C(O)\C=C/C(=O)O1
411716	AGK-2	BRD-K32536677	3.30E+01	probe	chromatin;pilot-set	SIRT2	inhibitor of sirtuin 2	ChemBridge Corporation;Tocris Bioscience	5857140;3233	Clc1ccc(Cl)c(c1)-c1ccc(\C=C(/C#N)C(=O)Nc2cccc3ncccc23)o1
411717	L-685458	BRD-K87317732	3.70E+01	probe	pilot-set	APH1A;NCSTN;PSEN1;PSENEN	inhibitor of gamma-secretase	Sigma-Aldrich	L1790	CC(C)C[C@H](NC(=O)[C@@H](C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
411719	PF-750	BRD-K83213911	2.70E+02	probe	pilot-set	FAAH	inhibitor of fatty acid amide hydrolase	Cayman	10010908	O=C(Nc1ccccc1)N1CCC(Cc2cnc3ccccc3c2)CC1
411720	triptolide	BRD-A13122391	3.00E-01	clinical	pilot-set		natural product; inhibitor of RNA polymerase II	Sigma-Aldrich	T3652	CC(C)[C@]12O[C@H]1[C@@H]1O[C@]11[C@]3(O[C@H]3CC3C4=C(CC[C@]13C)C(=O)OC4)[C@@H]2O
411722	nutlin-3	BRD-A12230535	1.50E+02	clinical	pilot-set	MDM2	inhibitor of p53-MDM2 interaction	Selleck	S1061	COc1ccc(C2=NC(C(N2C(=O)N2CCNC(=O)C2)c2ccc(Cl)cc2)c2ccc(Cl)cc2)c(OC(C)C)c1
411724	AA-COCF3	BRD-K07303502	2.70E+02	probe	pilot-set	FAAH;PLA2G4A;PLA2G4B;PLA2G4C;PLA2G4D	inhibitor of cytosolic phospholipase A2; inhibitor of fatty acid amide hydrolase	Cayman	62120	CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)C(F)(F)F
411726	16-beta-bromoandrosterone	BRD-K98404142	3.70E+01	probe	pilot-set		dehydroepiandrosterone (DHEA) analog	Sigma-Aldrich	B9392	C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@H](O)CC[C@]34C)[C@@H]1C[C@H](Br)C2=O
411727	PRL-3 inhibitor I	BRD-K09907482	1.30E+02	probe	pilot-set	PTP4A3	inhibitor of phosphatase of regenerating liver-3 (PRL3)	Sigma-Aldrich;EMD Biosciences	P0108;539808	Brc1ccc(OCc2ccccc2Br)c(\C=C2\SC(=S)NC2=O)c1
411731	SID 26681509	BRD-K08417745	3.00E+02	probe	pilot-set	CTSL1	inhibitor of cathepsin L	Tocris Bioscience	3625	CCc1ccccc1NC(=O)CSC(=O)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C
411733	neuronal differentiation inducer III	BRD-K53903639	2.70E+02	probe	chromatin;pilot-set		induction of rat HCN cell differentiation as judged by induction of neuronal reporter neuroD activity	EMD Biosciences	BRD3639	O=C(NC1CC1)c1cc(on1)-c1cccs1
411734	NSC 74859	BRD-K40853697	5.30E+02	probe	chromatin;pilot-set	STAT3	inhibitor of STAT3	Selleck	S1155	Cc1ccc(cc1)S(=O)(=O)OCC(=O)Nc1ccc(C(O)=O)c(O)c1
411737	bortezomib	BRD-K88510285	1.30E-01	FDA	CTEP;pilot-set;std-of-care	PSMB1;PSMB2;PSMB5;PSMD1;PSMD2	inhibitor of 26S proteasome	Toronto Research Chemicals;Selleck	B675700;S1013	CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
411738	ABT-737	BRD-K56301217	3.70E+01	clinical	pilot-set	BCL2;BCL2L1;BCL2L2	inhibitor of BCL2, BCL-xL, and BCL-W	Toronto Research Chemicals	A112550	CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1
411739	zebularine	BRD-A01145011	5.90E+02	probe	chromatin;pilot-set	DNMT1	inhibitor of DNA methyltransferases	Tocris Bioscience	2293	OC[C@H]1O[C@H](C(O)[C@H]1O)n1cccnc1=O
411742	PI-103	BRD-K67868012	3.70E+01	probe	kinome;pilot-set	MTOR;PIK3CA;PIK3CB;PIK3CD;PIK3CG;PRKDC	inhibitor of DNA-PK, PI3K p110 delta, mTORC1, and catalytic subunits of PI3K	Tocris Bioscience	2930	Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
411749	tubastatin A	BRD-K00627859	3.30E+01	probe	chromatin;pilot-set	HDAC6	inhibitor of tubulin deacetylase activity of HDAC6	Stanley Center for Psychiatric Research at the Broad Institute		CN1CCc2c(C1)c1ccccc1n2Cc1ccc(cc1)C(=O)NO
411770	SR-II-138A	BRD-K11172604	3.30E+01	probe	pilot-set	EIF4A2;EIF4E;EIF4G1	silvestrol analog; inhibits translation by modulating the eIF4F complex	Boston University		CON(C)C(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(O[C@]2([C@@H]1c1ccccc1)c1ccc(OC)cc1)cc(OC)cc3OC
411774	neopeltolide	BRD-K62479592	3.30E+01	probe	pilot-set		inhibitor of cellular respiration	Boston University		CCC[C@H]1C[C@H](C[C@H](C)C[C@@H]2C[C@H](C[C@H](CC(=O)O1)O2)OC(=O)\C=C/CCc1coc(\C=C/CNC(=O)OC)n1)OC
411792	parthenolide	BRD-K81651477	6.60E+01	probe	pilot-set		natural product; modulator of ROS; modulator of NF-kappa-B signaling	Tocris Bioscience;Tocris Bioscience	607;0610	C\C1=C\CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)C(=C)[C@@H]2CC1
411805	Compound 7d-cis	BRD-K61829047	3.30E+01	probe	pilot-set	XPO1	inhibitor of CRM1-mediated nucleocytoplasmic transport	WuXi AppTec	TH02330-015-1	CCOC(=O)\C=C/n1nnc(n1)-c1cccc(Cl)c1
411808	TG-101348	BRD-K12502280	3.70E+01	clinical	kinome;pilot-set	JAK2	inhibitor of Janus kinase 2	Selleck	S2736	Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(c1)S(=O)(=O)NC(C)(C)C
411809	pevonedistat	BRD-K67844266	3.70E+01	clinical	pilot-set	NAE1	inhibitor of Nedd-8 activating enzyme	WuXi AppTec	TH02333-012	NS(=O)(=O)OC[C@@H]1C[C@H](C[C@@H]1O)n1ccc2c(N[C@H]3CCc4ccccc34)ncnc12
411814	AZD7545	BRD-K52836380	7.40E+01	probe	kinome;pilot-set	PDK2	inhibitor of pyruvate dehydrogenase kinase 2	WuXi AppTec;WuXi AppTec	TH02357-029-A;TH02357-029-B	CN(C)C(=O)c1ccc(cc1)S(=O)(=O)c1ccc(NC(=O)[C@@](C)(O)C(F)(F)F)c(Cl)c1
411815	VER-155008	BRD-K32330832	3.70E+01	probe	pilot-set	HSPA1A;HSPA1B;HSPA1L	inhibitor of HSP70	WuXi AppTec	TH02357-035	Nc1ncnc2n([C@@H]3O[C@H](COCc4ccc(cc4)C#N)[C@@H](O)[C@H]3O)c(NCc3ccc(Cl)c(Cl)c3)nc12
411816	ML203	BRD-K80672993	3.70E+01	probe	pilot-set	PKM	activator of muscle pyruvate kinase (PKM2)	WuXi AppTec	TH02357-061	Nc1cccc(c1)S(=O)(=O)N1CCCN(CC1)S(=O)(=O)c1ccc2OCCOc2c1
411820	SRT-1720	BRD-K53855319	3.70E+01	probe	chromatin;pilot-set	SIRT1	activator of sirtuin-1	WuXi AppTec	TH02370-053	O=C(Nc1cc(CN2CCNCC2)cc(c1)-c1nc2ccccc2[nH]1)c1cnc2ccccc2n1
411824	CAY10594	BRD-K61662457	6.60E+01	probe	pilot-set	PLD2	inhibitor of phospholipase D2	Cayman	13207	O=C(NCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1ccc2ccccc2c1
411827	Compound 1541A	BRD-K30064966	3.70E+01	probe	pilot-set	CASP3;CASP6;CASP7	activators of executioner procaspases 3, 6, and 7	WuXi AppTec	TH02435-020-1	Oc1cccc2cc(C(=O)Nc3cccc(c3)-c3cn4ccccc4n3)c(=O)oc12
411831	RG-108	BRD-K89391146	2.70E+02	probe	pilot-set	DNMT1	inhibitor of DNA methyltransferase	Cayman	13302	OC(=O)[C@H](Cc1c[nH]c2ccccc12)N1C(=O)c2ccccc2C1=O
411832	PAC-1	BRD-K92991072	3.30E+01	probe	pilot-set	CASP3	activator of procaspase-3	Tocris Bioscience	2581	Oc1c(CC=C)cccc1\C=N\NC(=O)CN1CCN(Cc2ccccc2)CC1
411833	pluripotin	BRD-K98538768	3.30E+01	probe	pilot-set	MAPK1;RASAL1	promoter of embryonic stem cell self-renewal; inhibitor of Ras-GAP and ERK	Cayman	10009557	CN1C(=O)N(Cc2cnc(Nc3cc(C)nn3C)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C
411843	GMX-1778	BRD-K47335880	3.00E-01	clinical	pilot-set	NAMPT	inhibitor of nicotinamide phosphoribosyltransferase	WuXi AppTec;Cayman	TH-2360-010-1;11021	Clc1ccc(OCCCCCC\N=C(\NC#N)Nc2ccncc2)cc1
411856	avrainvillamide	BRD-K10466330	3.30E+01	probe	pilot-set	NPM1	natural product; inhibitor of nucleophosmin	Harvard University		CC1(C)Oc2ccc3C4=C[C@@]56NC(=O)[C@]7(CCCN7C5=O)C[C@H]6C(C)(C)C4=[N+]([O-])c3c2C=C1
411859	BMS-536924	BRD-K34581968	3.70E+01	probe	pilot-set	IGF1R;INSR	inhibitor of insulin-like growth factor 1 receptor (IGF1R) and insulin receptor (INSR)	Selleck	S1012	Cc1cc(cc2[nH]c(nc12)-c1c(NC[C@@H](O)c2cccc(Cl)c2)cc[nH]c1=O)N1CCOCC1
411863	gemcitabine	BRD-K15108141	3.30E+01	FDA	pilot-set;std-of-care	CMPK1;RRM1;TYMS	inhibitor of DNA replication; inhibitor of ribonucleotide reductase, thymidylate synthetase, and cytidine monophosphate (UMP-CMP) kinase 	Selleck	S1714	Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(=O)n1
411865	MST-312	BRD-K19894101	3.30E+01	probe	chromatin;pilot-set	TERT	inhibitor of telomerase reverse transcriptase	Sigma-Aldrich	M3949	Oc1cccc(C(=O)Nc2cccc(NC(=O)c3cccc(O)c3O)c2)c1O
411867	olaparib	BRD-K02113016	1.50E+02	clinical	chromatin;pilot-set	PARP1;PARP2	inhibitor of poly (ADP-ribose) polymerase 1 and 2	Selleck	S1060	Fc1ccc(Cc2n[nH]c(=O)c3ccccc23)cc1C(=O)N1CCN(CC1)C(=O)C1CC1
411869	oligomycin A	BRD-A81541225	3.30E+01	probe	pilot-set	ATP5L2	inhibitor of mitochondrial ATP synthase	Sigma-Aldrich	75351	CCC1CCC2OC3(CC[C@@H](C)C(C[C@H](C)O)O3)[C@H](C)C(OC(=O)\C=C\[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@H](C)C(=O)[C@@](C)(O)[C@H](O)[C@@H](C)C\C=C\C=C\1)[C@H]2C
411874	indisulam	BRD-K17610631	3.30E+01	clinical	chromatin;pilot-set	CA9	inhibitor of carbonic anhydrase isoform IX	MedKoo Biosciences		NS(=O)(=O)c1ccc(cc1)S(=O)(=O)Nc1cccc2c(Cl)c[nH]c12
414479	BRD-K49290616	BRD-K49290616	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		OC[C@@H]1O[C@@H](CC(=O)NCc2ccncn2)CC[C@H]1NC(=O)c1ccc(F)cc1
415688	BRD-K02492147	BRD-K02492147	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CN1CCN(CC1)C(=O)C[C@@H]1O[C@H](CO)[C@@H](NS(=O)(=O)c2cccc(F)c2)C=C1
416775	austocystin D	BRD-K25987073	3.70E+01	probe	pilot-set		natural product; inducer of DNA damage	Harvard Medical School		CC(C)(O)CCc1ccc(O)c2c1oc1cc3O[C@H]4OC=C[C@@]4(O)c3c(O)c1c2=O
416777	SJ-172550	BRD-K93095519	3.30E+01	probe	pilot-set	MDM2;TP53	inhibitor of p53-MDM2 interaction	Tocris Bioscience	3929	CCOc1cc(cc(Cl)c1OCC(=O)OC)\C=C1C(=O)N(N=C/1C)c1ccccc1
416842	BRD-K09587429	BRD-K09587429	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@@H](NC(=O)C[C@@H]1CC[C@@H](NC(=O)CN2CCOCC2)[C@H](CO)O1)c1ccccc1
417098	pandacostat	BRD-K44741158	3.30E+01	probe	chromatin;pilot-set	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8	Harvard Medical School		ONC(=O)\C=C\c1ccc(cc1)C(=O)N\N=C\c1ccc(O)c(O)c1O
417262	BRD-K96431673	BRD-K96431673	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CN1CCN(CC1)C(=O)C[C@H]1CC[C@H](NC(=O)c2ccc3OCOc3c2)[C@@H](CO)O1
417415	cyanoquinoline 11	BRD-K00088062	1.30E+02	clinical	kinome;pilot-set	MAP3K8	inhibitor of MAP3K8; inhibitor of phosphorylated EGFR in cells	WuXi AppTec	TH02434-056	Fc1ccc(Nc2c(cnc3c(Cl)cc(NCc4cnc[nH]4)cc23)C#N)cc1Cl
417416	tipifarnib-P2	BRD-K62965247	3.30E+01	probe	pilot-set	FNTA	inhibitor of farnesyltransferase	WuXi AppTec	TH02436-025 - P2	Cn1cncc1[C@@](N)(c1ccc(Cl)cc1)c1ccc2n(C)c(=O)cc(-c3cccc(Cl)c3)c2c1
417417	tipifarnib-P1	BRD-K63195589	3.30E+01	clinical	pilot-set	FNTA	inhibitor of farnesyltransferase	WuXi AppTec;Selleck	TH02436-025 - P1;S1453	Cn1cncc1[C@](N)(c1ccc(Cl)cc1)c1ccc2n(C)c(=O)cc(-c3cccc(Cl)c3)c2c1
417451	Compound 23 citrate	BRD-K67112618	3.30E+01	probe	pilot-set		analog of natural product cortistatin	Harvard University		CN(C)[C@H]1CC[C@H]2[C@@H](CC[C@H]3[C@@H]4CC=C(c5ccc6cnccc6c5)[C@@]4(C)CC[C@H]23)C1
417452	nakiterpiosin	BRD-K38264551	3.30E+01	probe	pilot-set		natural product; inhibitor of microtubule assembly	University of Texas, Southwestern		C[C@H]1C[C@@H](OC1=O)[C@@H](O)[C@@H](C(Cl)Cl)c1ccc2[C@@H]3C[C@@H](Br)[C@]45O[C@H](C[C@]4(C)[C@H]3C(=O)c2c1C)CO[C@H]5O
417663	CCT036477	BRD-A22997170	3.30E+01	probe	pilot-set		inhibitor of WNT signaling by blocking beta-catenin transcription	Sigma-Aldrich	SML0151	Cc1[nH]c2ccccc2c1C(Nc1ccccn1)c1ccc(Cl)cc1
417818	tamatinib	BRD-K20285085	3.30E+01	clinical	CTEP;kinome;pilot-set	SYK	inhibitor of spleen tyrosine kinase	Selleck	S2194	COc1cc(Nc2ncc(F)c(Nc3ccc4OC(C)(C)C(=O)Nc4n3)n2)cc(OC)c1OC
417977	myriocin	BRD-A76279427	3.30E+01	probe	pilot-set	SPTLC1;SPTLC2;SPTLC3	inhibitor of serine palmitoyltransferase	Sigma-Aldrich	M1177	CCCCCCC(=O)CCCCCC\C=C\C[C@H](O)[C@@H](O)C(N)(CO)C(O)=O
417979	YM-155	BRD-K76703230	1.00E+00	clinical	pilot-set	BIRC5	inhibitor of survivin expression	Active Biochem	A-1061	COCCn1c2c(C(=O)c3ccccc3C2=O)[n+](Cc2cnccn2)c1C
417981	BMS-754807	BRD-K13049116	3.30E+01	probe	pilot-set	IGF1R	inhibitor of insulin-like growth factor 1 receptor and insulin receptor	Active Biochem	A-1013	C[C@]1(CCCN1c1nc(Nc2cc(n[nH]2)C2CC2)c2cccn2n1)C(=O)Nc1ccc(F)nc1
417982	BIBR-1532	BRD-K04623885	2.70E+02	probe	chromatin;pilot-set	TERT	inhibitor of telomerase reverse transcriptase	Selleck	S1186	C\C(=C/C(=O)Nc1ccccc1C(O)=O)c1ccc2ccccc2c1
417987	tosedostat	BRD-K92241597	2.70E+02	clinical	pilot-set	ANPEP;LAP3;NPEPPS	inhibitor of leucine aminopeptidase 3 (LAP), puromycin-sensitive aminopeptidase (PuSA), and aminopeptidase N	Selleck	S1522	CC(C)C[C@H]([C@H](O)C(=O)NO)C(=O)N[C@H](C(=O)OC1CCCC1)c1ccccc1
418038	neratinib	BRD-K85606544	3.30E+01	clinical	kinome;pilot-set	EGFR;ERBB2	inhibitor of EGFR and HER2	WuXi AppTec	HKI-272	CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
418162	BRD1812	BRD-K73261812	6.60E+01	probe	pilot-set		screening hit	ChemPacific	46704	Oc1ccc(C[C@@H]2N3[C@H](CN(Cc4cccc5ccccc45)C2=O)N(CCC3=O)C(=O)NCc2ccccc2)cc1
418163	BRD8958	BRD-K68548958	6.60E+01	probe	chromatin;pilot-set	EP300	inhibitor of E1A binding protein p300	Princeton BioMolecular Research	OSSK_701387	CC1=NN(C(=O)C\1=C\c1ccc(o1)-c1cc(C)c(C)cc1[N+]([O-])=O)c1ccc(cc1)C(O)=O
418164	serdemetan	BRD-K60219430	3.30E+01	clinical	pilot-set	MDM2	inhibitor of MDM2	Axon Medchem	1538	C(Cc1c[nH]c2ccccc12)Nc1cccc(Nc2ccncc2)c1
418166	daporinad	BRD-K58550667	2.00E+00	clinical	pilot-set	NAMPT	inhibitor of nicotinamide phosphoribosyltransferase	Axon Medchem;Cayman	1279;13287	O=C(NCCCCC1CCN(CC1)C(=O)c1ccccc1)\C=C\c1cccnc1
418167	MK-1775	BRD-K54256913	3.30E+01	clinical	CTEP;kinome;pilot-set	WEE1	inhibitor of WEE1	Axon Medchem	1494	CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(-c2cccc(n2)C(C)(C)O)n(CC=C)c3=O)cc1
418170	tivozanib	BRD-K53414658	3.30E+01	clinical	pilot-set	FLT1;FLT3;KDR	inhibitor of VEGFRs	Selleck	S1207	COc1cc2nccc(Oc3ccc(NC(=O)Nc4cc(C)on4)c(Cl)c3)c2cc1OC
418172	Ko-143	BRD-K64642496	1.30E+02	probe	pilot-set	ABCG2	inhibitor of breast cancer resistance protein multidrug transporter (BCRP)	Sigma-Aldrich	K2144	COc1ccc2c3C[C@@H]4N([C@@H](CC(C)C)c3[nH]c2c1)C(=O)[C@H](CCC(=O)OC(C)(C)C)NC4=O
418209	CR-1-31B	BRD-K23547378	3.30E+01	probe	pilot-set	EIF4A2;EIF4E;EIF4G1	silvestrol analog; inhibits translation by modulating the eIF4F complex	Boston University		CONC(=O)[C@H]1[C@@H](O)[C@@]2(O)c3c(O[C@]2([C@@H]1c1ccccc1)c1ccc(OC)cc1)cc(OC)cc3OC
425733	BRD-K71781559	BRD-K71781559	6.60E+01	probe	outreach		screening hit	National Cancer Institute Chemotherapeutic Agents Repository		OC(=O)c1ccc(NCc2nc3cc4ccccc4cc3[nH]2)cc1
429535	BRD-K86535717	BRD-K86535717	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CO[C@@H]1CC[C@H]2CCN(C)C(=O)[C@@H](C)[C@H](CN(C)C(=O)c3cccc(C#N)c3OC[C@H]1O2)OC
431987	BRD-K48334597	BRD-K48334597	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)NC2CCCCC2)Oc2ccc(NC(=O)Cc3cn(C)c4ccccc34)cc2C1=O
434195	ML312	BRD-K70809902	6.60E+01	probe	MLPCN;outreach	SCARB1	inhibitor of scavenger receptor class B, member 1 (SCARB1)-mediated lipid uptake	Broad Institute of MIT and Harvard		CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(=O)(=O)c3ccc(Cl)cc3)[C@H](C)CN([C@H](C)CO)C(=O)c2c1
435086	BRD-K04800985	BRD-K04800985	6.70E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)CC2CCCCC2)Oc2ccc(NC(=O)Nc3c(C)noc3C)cc2C1=O
435898	BRD-K78574327	BRD-K78574327	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@H](C)[C@H](CN(C)CC2CC2)Oc2ccc(NS(=O)(=O)c3cn(C)cn3)cc2C1=O
436211	BRD-K19103580	BRD-K19103580	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc(Cl)c(Cl)c2)Oc2ccc(cc2C1=O)N(C)C
437263	BRD-K30019337	BRD-K30019337	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CC(C)NC(=O)N(C)C[C@H]1Oc2ccc(cc2C(=O)N(C[C@H]1C)[C@H](C)CO)N(C)C
437906	BRD-K84807411	BRD-K84807411	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C)Oc2c(NC(=O)c3cc(C)nn3C)cccc2C1=O
438345	BRD-K01737880	BRD-K01737880	6.60E+01	probe	outreach		screening hit	Broad Institute of MIT and Harvard		COc1ccc(NC(=O)Nc2ccc3O[C@@H](CN(C)Cc4ccc5OCOc5c4)[C@@H](C)CN([C@@H](C)CO)C(=O)c3c2)cc1
438564	BRD-K44224150	BRD-K44224150	3.40E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CNC[C@@H]1Oc2ccc(NC(=O)C3CCCCC3)cc2C(=O)N(C[C@@H]1C)[C@@H](C)CO
438691	BRD-K75293299	BRD-K75293299	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2c(NC(=O)c3ccncc3)cccc2C1=O
438776	BRD-K64610608	BRD-K64610608	3.30E+01	probe	DOS;outreach		product of diversity oriented synthesis; screening hit	Broad Institute of MIT and Harvard		COc1ccc(cc1)S(=O)(=O)N(C)C[C@@H]1Oc2c(NC(=O)Nc3cccc4ccccc34)cccc2C(=O)N(C[C@H]1C)[C@@H](C)CO
439882	BRD-K09344309	BRD-K09344309	3.30E+01	probe	DOS;outreach		screening hit	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@@H](C)[C@H](CN(C)Cc2ccc3OCOc3c2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O
442141	BRD-K02251932	BRD-K02251932	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)NC2CCCCC2)Oc2c(NS(=O)(=O)c3ccc(F)cc3)cccc2C1=O
444779	BRD-K55116708	BRD-K55116708	6.60E+01	probe	DOS;outreach		product of diversity oriented synthesis; inhibitor of leukemic stem cells	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc2ccccc2N)Oc2c(NC(=O)Nc3ccccc3)cccc2C1=O
446546	BRD-K41334119	BRD-K41334119	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CNC[C@@H]1Oc2ccc(NS(C)(=O)=O)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO
446716	BRD-K34485477	BRD-K34485477	3.30E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CNC[C@@H]1Oc2ccc(NC(=O)CCN3CCOCC3)cc2CC(=O)N(C[C@@H]1C)[C@H](C)CO
447732	BRD-K16147474	BRD-K16147474	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CC(C)NC(=O)Nc1ccc2O[C@@H](CN(C)S(C)(=O)=O)[C@@H](C)CN([C@H](C)CO)C(=O)Cc2c1
448891	BRD-K29086754	BRD-K29086754	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(O)=O)Oc2ccc(NC(=O)Nc3ccc(F)cc3)cc2CC1=O
449707	BRD-K33199242	BRD-K33199242	6.70E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CNC[C@@H]1Oc2ccc(cc2CC(=O)N(C[C@@H]1C)[C@@H](C)CO)N(C)C
450415	BRD-K52037352	BRD-K52037352	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@@H](CO)N1C[C@H](C)[C@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)NC3CCCCC3)cc2CC1=O
452570	BRD-K27986637	BRD-K27986637	6.60E+01	probe	DOS;outreach		product of diversity oriented synthesis; screening hit	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@H](C)[C@H](CN(C)Cc2ccc3OCCOc3c2)OCc2cn(CCCC1=O)nn2
463198	BRD-K37390332	BRD-K37390332	3.30E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)C(=O)Nc2cccc3ccccc23)Oc2ccc(NC(=O)c3ccncc3)cc2CC1=O
464458	tandutinib	BRD-K89162000	6.60E+01	clinical	CTEP;kinome	FLT3;KIT	inhibitor of c-KIT and VEGFR3	Selleck	S1043	COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
464880	fulvestrant	BRD-A85667082	6.60E+01	FDA	std-of-care	ESR1;GPER1	antagonist of the estrogen receptor	Selleck	S1191	C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)[C@H](CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F)Cc1cc(O)ccc31
467037	bafilomycin A1	BRD-K86787118	3.30E-01	probe	outreach	ATP6V0A1	inhibitor of the vacuolar-type H+-ATPase	EMD Biosciences	BML-CM110-0100	CO[C@H]1\C=C\C=C(C)\C[C@@H](C)[C@H](O)[C@H](C)\C=C(C)\C=C(OC)\C(=O)O[C@@H]1[C@@H](C)[C@@H](O)[C@H](C)[C@H]1C[C@@H](O)[C@H](C)[C@H](O1)C(C)C
478694	isonicotinohydroxamic acid	BRD-K55478147	3.30E+01	probe	chromatin;lit-search;outreach	HDAC6	inhibitor of HDAC6	Stanley Center for Psychiatric Research at the Broad Institute		ONC(=O)c1ccncc1
481311	HLI 373	BRD-K17349619	3.30E+01	probe	pilot-set	MDM2	inhibitor of MDM2	Tocris Bioscience	3503	CN(C)CCCNc1c2ccccc2n(C)c2nc(=O)n(C)c(=O)c12
580922	NSC19630	BRD-K39706510	6.60E+01	probe	lit-search	WRN	inhibitor of Werner syndrome helicase activity	EMD Biosciences	681467	CCC(=O)OCN1C(=O)C=CC1=O
594399	NSC48300	BRD-K45748132	6.60E+01	probe	outreach	TASP1	inhibitor of threonine endopeptidase taspase 1	National Cancer Institute Chemotherapeutic Agents Repository		O[As](O)(=O)c1ccc(Cc2ccc(cc2)[As](O)(O)=O)cc1
594663	PRIMA-1-Met	BRD-K49456190	3.30E+01	probe	pilot-set	TP53	re-activator of the pro-apoptotic activity of mutant p53	Tocris Bioscience	3710	COC[C@]1(CO)[N@@]2CC[C@@H](CC2)C1=O
594664	isoevodiamine	BRD-A68631409	3.30E+01	probe	pilot-set		natural product	Sigma-Aldrich	E3531	CN1C2N(CCc3c2[nH]c2ccccc32)C(=O)c2ccccc12
594665	UNC0638	BRD-K86856088	3.30E+01	probe	chromatin;lit-search;pilot-set	EHMT1;EHMT2	inhibitor of EHMT2 and GLP methyltransferase	Tocris Bioscience	4343	COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1OCCCN1CCCC1)C1CCCCC1
595102	cucurbitacin I	BRD-A28105619	3.30E+01	probe	chromatin;outreach		natural product; modulator of NFKB1 and STAT3 signaling	Tocris Bioscience	1571	CC(C)(O)\C=C\C(=O)[C@](C)(O)C1[C@H](O)C[C@@]2(C)C3CC=C4C(CC(=O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C
596868	BRD-K50799972	BRD-K50799972	6.60E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		COc1ccccc1-c1cccc(c1)-c1nc(cc2CN([C@@H](CCO)c12)[S@@](=O)C(C)(C)C)C(=O)NCc1ccncc1
600054	BRD-K17060750	BRD-K17060750	6.70E+01	GE-active	DOS;profiling		product of diversity oriented synthesis	Broad Institute of MIT and Harvard		CN(C)CC(=O)N[C@@H]1CC[C@@H](CCNC(=O)Nc2ccc(F)cc2)O[C@H]1CO
601923	barasertib	BRD-K63923597	6.60E+01	clinical	kinome	AURKB	inhibitor of aurora kinase B	Selleck	S1147	CCN(CCO)CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)[nH]n3)ncnc2c1
606033	linifanib	BRD-K99749624	6.60E+01	clinical	kinome	FLT1;FLT3;KDR	inhibitor of VEGFRs	Selleck	S1003	Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
606034	veliparib	BRD-K87142802	3.30E+01	clinical	chromatin;CTEP;pilot-set	PARP1;PARP2	inhibitor of poly (ADP-ribose) polymerase 1 (PARP1) and 2 (PARP2)	Selleck	S1004	C[C@@]1(CCCN1)c1nc2c(cccc2[nH]1)C(N)=O
606035	saracatinib	BRD-K19540840	6.60E+01	clinical	CTEP;kinome	ABL1;SRC	inhibitor of SRC and ABL1	Selleck	S1006	CN1CCN(CCOc2cc(OC3CCOCC3)c3c(Nc4c5OCOc5ccc4Cl)ncnc3c2)CC1
606135	afatinib	BRD-K66175015	6.60E+01	clinical	kinome	EGFR;ERBB2	inhibitor of EGFR and HER2	Selleck	S1011	CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1
606136	cediranib	BRD-K86930074	6.60E+01	clinical	CTEP;kinome	FLT1;FLT4;KDR	inhibitor of VEGFRs	Selleck	S1017	COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
606138	canertinib	BRD-K50168500	6.60E+01	clinical	kinome	EGFR;ERBB2	inhibitor of EGFR and HER2	Selleck	S1019	Fc1ccc(Nc2ncnc3cc(OCCCN4CCOCC4)c(NC(=O)C=C)cc23)cc1Cl
606142	obatoclax	BRD-K15600710	6.60E+01	clinical	CTEP	BCL2;BCL2L1;MCL1	inhibitor of MCL1, BCL2, and BCL-xL	Selleck	S1057	COC1=CC(=N\C\1=C/c1[nH]c(C)cc1C)c1cc2ccccc2[nH]1
606143	masitinib	BRD-K71035033	6.60E+01	clinical	kinome	KIT;PDGFRA;PDGFRB	inhibitor of c-KIT, PDGFRA, and PDGFRB	Selleck	S1064	CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nc(cs3)-c3cccnc3)c2)CC1
606144	ZSTK474	BRD-K63068307	6.60E+01	clinical	kinome	PIK3CB;PIK3CD;PIK3CG	inhibitor of PI3K catalytic subunits beta, delta, and gamma	Selleck	S1072	FC(F)c1nc2ccccc2n1-c1nc(nc(n1)N1CCOCC1)N1CCOCC1
606246	brivanib	BRD-K28428262	6.60E+01	clinical	lit-search	FLT1;KDR	inhibitor of VEGFR 1/2	Selleck	S1084	C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
606248	GDC-0879	BRD-K67578145	6.60E+01	probe	kinome	BRAF	inhibitor of BRAF	Selleck	S1104	OCCn1cc(c(n1)-c1ccncc1)-c1ccc2c(CC\C2=N/O)c1
606249	NVP-TAE684	BRD-K50140147	6.60E+01	probe	kinome	ALK	inhibitor of ALK and ALK-NPM fusion protein	Selleck	S1108	COc1cc(ccc1Nc1ncc(Cl)c(Nc2ccccc2S(=O)(=O)C(C)C)n1)N1CCC(CC1)N1CCN(C)CC1
606254	SNS-032	BRD-K43389698	6.60E+01	clinical	chromatin;kinome;lit-search	CDK16;CDK17;CDK2;CDK7;CDK9;CDKL5	inhibitor of cyclin-dependent kinases	Selleck	S1145	CC(C)(C)c1cnc(CSc2cnc(NC(=O)C3CCNCC3)s2)o1
606256	PLX-4720	BRD-K16478699	3.30E+01	probe	kinome	BRAF	inhibitor of BRAF	Selleck	S1152	CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
606356	TGX-221	BRD-A41692738	6.60E+01	probe	kinome	PIK3CB	inhibitor of PI3K catalytic subunit beta	Selleck	S1169	CC(Nc1ccccc1)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
606363	KU-0063794	BRD-K67566344	6.60E+01	probe	kinome	MTOR	inhibitor of mTOR	Selleck	S1226	COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1C[C@H](C)O[C@H](C)C1)N1CCOCC1
606470	TG-100-115	BRD-K64785675	6.60E+01	clinical	kinome	PIK3CD;PIK3CG	inhibitor of PI3K catalytic subunits delta and gamma	Selleck	S1352	Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
606471	GSK1059615	BRD-K06750613	3.30E+01	clinical	kinome	MTOR;PIK3CA;PIK3CB;PIK3CD;PIK3CG	inhibitor of PI3K and mTOR kinase activity	Selleck	S1360	O=C1NC(=O)\C(S1)=C\c1ccc2nccc(-c3ccncc3)c2c1
606586	SU11274	BRD-K02965346	6.60E+01	probe	kinome	MET	inhibitor of MET	Selleck	S1080	CN(c1cccc(Cl)c1)S(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c(C)c(C(=O)N4CCN(C)CC4)c3C)c2c1
606670	BRD-K88742110	BRD-K88742110	6.60E+01	probe	chromatin;outreach	HDAC8	inhibitor of HDAC8	Stanley Center for Psychiatric Research at the Broad Institute		COc1ccc(Cn2ccc3ccc(cc23)C(=O)NO)cc1
607696	LRRK2-IN-1	BRD-K01436366	6.60E+01	probe	kinome	DCLK1;LRRK2	inhibitor of leucine-rich repeat kinase 2; inhibitor of doublecortin-like kinase	EMD Biosciences	438193	COc1cc(ccc1Nc1ncc2N(C)C(=O)c3ccccc3N(C)c2n1)C(=O)N1CCC(CC1)N1CCN(C)CC1
608062	BRD8899	BRD-K22828899	3.30E+01	probe	lit-search;synthesis	STK33	inhibitor of serine/threonine kinasase STK33	Broad Institute of MIT and Harvard		CC(=O)NC[C@@H]1C[C@H](CN1)NS(=O)(=O)c1cccc2cncc(C)c12
608999	EX-527	BRD-K76964878	8.00E+01	clinical	chromatin;pilot-set	SIRT1	inhibitor of sirtuin 1	Selleck	S1541	NC(=O)[C@H]1CCCc2c1[nH]c1ccc(Cl)cc21
609056	ELCPK	BRD-K44847641	4.00E-01	probe	pilot-set		screening hit	ChemDiv Inc.	G408-2080	O=S(=O)(N1CCCc2ccccc12)c1ccc(cc1)-c1cnc(o1)C1CC1
609058	NPC-26	BRD-K36852164	4.00E+01	probe	pilot-set		induces cell death through a non-apoptotic, mitochondrial-dependent mechanism	Columbia University		CCOC(=O)c1c(NC(=O)c2ccc(s2)[N+]([O-])=O)sc2c1CC(C)(C)NC2(C)C
609060	1S,3R-RSL-3	BRD-K23853216	3.30E+01	probe	pilot-set	GPX4	synthetic lethal with HRAS in engineered cells; inhibitor of GPX4	Columbia University		COC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H](N1C(=O)CCl)c1ccc(cc1)C(=O)OC
609061	CIL55A	BRD-K69982010	8.00E+01	probe	pilot-set		screening hit	Columbia University		CN(C)CCNC(=O)c1cc2CSc3ccc(Cl)cc3-c2s1
609062	SCH-529074	BRD-K24376488	3.30E+01	probe	pilot-set	TP53	activator of mutant p53	Broad Institute of MIT and Harvard		CN(C)CCCNc1nc(CN2CCN(CC2)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)nc2ccccc12
609063	StemRegenin 1	BRD-K36739687	6.60E+01	probe	chromatin;lit-search;outreach	AHR	inhibitor of aryl hydrocarbon receptor	BioVision	1967-5	CC(C)n1cnc2c(NCCc3ccc(O)cc3)nc(nc12)-c1csc2ccccc12
609091	FQI-2	BRD-K35498412	3.30E+01	probe	chromatin;pilot-set		inhibitor of LSF1-mediated transcription	Boston University		CCOc1ccccc1-c1cc(=O)[nH]c2cc3OCOc3cc12
609110	ML210	BRD-K01877528	3.30E+01	probe	pilot-set		selectively kills engineered cells expressing mutant HRAS	Broad Institute of MIT and Harvard		Cc1onc(C(=O)N2CCN(CC2)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1[N+]([O-])=O
609121	darinaparsin	BRD-K35723520	3.30E+01	clinical	pilot-set		inducer of ROS; inhibitor of microtubule assembly	Sigma-Aldrich	D2071	C[As](C)SC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O
609124	PX-12	BRD-A56592690	1.00E+02	clinical	pilot-set	TXN	inhibitor of thioredoxin-1	Sigma-Aldrich	M5324	CCC(C)SSc1ncc[nH]1
609332	GANT-61	BRD-K09485525	6.60E+01	probe	chromatin;lit-search		inhibitor of hedgehog signaling pathway	Tocris Bioscience	3191	CN(C)c1ccccc1CN1CCCN(Cc2ccccc2N(C)C)C1c1ccncc1
609440	PL-DI	BRD-K83336168	6.60E+01	probe	pilot-set		dimer of piperlongumine; inducer of ROS	Broad Institute of MIT and Harvard		COc1cc(\C=C\C(=O)N2CCC=CC2=O)cc(OC)c1OCCN(C)CCOc1c(OC)cc(\C=C\C(=O)N2CCC=CC2=O)cc1OC
609596	TW-37	BRD-K28360340	3.30E+01	probe	pilot-set	BCL2;BCL2L1	inhibitor of BCL2 and BCL-xL	Tocris Bioscience	4038	CC(C)c1ccccc1Cc1cc(C(=O)Nc2ccc(cc2)S(=O)(=O)c2ccccc2C(C)(C)C)c(O)c(O)c1O
609639	AZD8055	BRD-K69932463	6.60E+01	clinical	kinome	MTOR	inhibitor of mTOR	Selleck	S1555	COc1ccc(cc1CO)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C
609674	CHM-1	BRD-K94145482	1.60E+01	probe	pilot-set		inhibitor of tubulin polymerization	Tocris Bioscience	3868	Fc1ccccc1-c1cc(=O)c2cc3OCOc3cc2[nH]1
609681	QS-11	BRD-K02526760	3.30E+01	probe	pilot-set	ARFGAP1	inhibitor of GTPase activating protein of ARF 1 (ARFGAP1)	Tocris Bioscience	3324	OC[C@H](Cc1ccccc1)Nc1nc(Oc2ccc3CCCc3c2)nc2n(Cc3ccc(cc3)-c3ccccc3)cnc12
609781	ML239	BRD-K01121114	6.60E+01	probe	MLPCN;outreach		ML239; inhibitor of breast cancer stem cell proliferation	Broad Institute of MIT and Harvard		Clc1cc(Cl)c(OCC(=O)N\N=C\c2ccc[nH]2)c(Cl)c1
616352	salermide	BRD-A67788537	4.00E+02	probe	chromatin;lit-search;pilot-set	SIRT1;SIRT2	inhibitor of sirtuin 1 and sirtuin 2	Cayman	13178	CC(C(=O)Nc1cccc(c1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1
616353	fumonisin B1	BRD-A63646118	5.00E+02	probe	pilot-set	CERS1;CERS2;CERS3;CERS4;CERS5;CERS6	inhibitor of ceramide synthase	Cayman	62580	CCCC[C@@H](C)[C@@H](OC(=O)C[C@@H](CC(O)=O)C(O)=O)[C@H](CC(C)C[C@H](O)CCCC[C@@H](O)C[C@H](O)[C@H](C)N)OC(=O)C[C@@H](CC(O)=O)C(O)=O
616354	JQ-1	BRD-K54606188	6.60E+01	probe	chromatin;lit-search;pilot-set	BRDT	inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins	Dana Farber Cancer Institute		Cc1sc-2c(c1C)C(=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n-21)c1ccc(Cl)cc1
616355	BRD-K51490254	BRD-K51490254	6.60E+01	probe	chromatin;outreach	HDAC6;HDAC8	inhibitor of HDAC6 and HDAC8	Stanley Center for Psychiatric Research at the Broad Institute		ONC(=O)c1cccc(c1)C(=O)Nc1ccccc1
616408	BRD-K85133207	BRD-K85133207	6.60E+01	probe	chromatin;outreach	HDAC1	inhibitor of HDAC1	Stanley Center for Psychiatric Research at the Broad Institute		CC(=O)N[C@H]1C[C@H](C1)C(=O)Nc1cc(ccc1N)-c1ccc(F)cc1
622911	BMS-345541	BRD-K13566078	6.60E+01	probe	kinome	IKBKB	inhibitor of IKK-2	Axon Medchem	Axon 1731	Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
622913	CAY10576	BRD-K51781482	6.60E+01	probe	kinome;outreach	IKBKE	inhibitor of IKK-epsilon	Calbiochem	401488	COc1cc2ncn(-c3cc(OCc4ccccc4S(C)(=O)=O)c(s3)C#N)c2cc1OC
628408	Repligen 136	BRD-K47503321	6.60E+01	probe	chromatin;outreach	HDAC3	inhibitor of HDAC3	Stanley Center for Psychiatric Research at the Broad Institute		Cc1ccc(cc1)C(=O)NCCCCCC(=O)Nc1ccc(F)cc1N
628601	nintedanib	BRD-K49075727	6.60E+01	clinical	kinome	FGFR1;FGFR2;FGFR3;FLT1;FLT3;KDR;PDGFRA;PDGFRB	inhibitor of c-KIT, VEGFRs, PDGFRs, and FGFRs	Selleck	S1010	COC(=O)c1ccc2c(NC(=O)\C2=C(/Nc2ccc(cc2)N(C)C(=O)CN2CCN(C)CC2)c2ccccc2)c1
628603	crizotinib	BRD-K78431006	6.60E+01	FDA	kinome;std-of-care	ALK;MET	inhibitor of c-MET and ALK	Selleck	S1068	C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl
628607	foretinib	BRD-K03449891	6.60E+01	clinical	kinome	KDR;MET	inhibitor of MET and VEGFR2	Selleck	S1111	COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3F)ccnc2cc1OCCCN1CCOCC1
628613	regorafenib	BRD-K16730910	6.60E+01	FDA	kinome	BRAF;KDR;KIT;RET	inhibitor of BRAF, RET, KIT, and VEGFR2	Selleck	S1178	CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)c(F)c2)ccn1
628614	WZ8040	BRD-K81728688	6.60E+01	probe	kinome	EGFR	inhibitor of EGFR targeting T790M resistance	Selleck	S1179	CN1CCN(CC1)c1ccc(Nc2ncc(Cl)c(Sc3cccc(NC(=O)C=C)c3)n2)cc1
628620	OSI-930	BRD-K25340465	6.60E+01	clinical	kinome	KDR;KIT	inhibitor of c-KIT and VEGFR2	Selleck	S1220	FC(F)(F)Oc1ccc(NC(=O)c2sccc2NCc2ccnc3ccccc23)cc1
628622	MGCD-265	BRD-K56277358	6.60E+01	clinical	kinome	FLT1;FLT3;KDR;MET	inhibitor of c-MET and VEGFRs	Selleck	S1361	Cn1cnc(c1)-c1cc2nccc(Oc3ccc(NC(=S)NC(=O)Cc4ccccc4)cc3F)c2s1
628639	lenvatinib	BRD-K39974922	6.60E+01	FDA	lit-search	FLT1;FLT3;KDR;KIT;PDGFRA;PDGFRB	inhibitor of VEGFRs, c-KIT, and PDGFR alpha and beta	Selleck	S1164	COc1cc2nccc(Oc3ccc(NC(=O)NC4CC4)c(Cl)c3)c2cc1C(N)=O
632103	YK 4-279	BRD-A62182663	3.30E+01	probe	chromatin;pilot-set	DHX9;ERG;ETV1	inhibitor of RNA helicase A (RHA) binding to EWS-FLI1; inhibitor of ERG and ETV1 activity	Tocris Bioscience	4067	COc1ccc(cc1)C(=O)CC1(O)C(=O)Nc2c1c(Cl)ccc2Cl
632104	CAY10618	BRD-K83289131	3.30E+01	probe	pilot-set	NAMPT	inhibitor of nicotinamide phosphoribosyltransferase	Cayman	13670	O=C(CCCCCCCn1cc(nn1)-c1cccnc1)Nc1ccccc1-c1ccccc1
632119	KU 0060648	BRD-K09499853	3.30E+01	probe	kinome;pilot-set	PRKDC	inhibitor of DNA-dependent protein kinase	Axon Medchem	1584	CCN1CCN(CC(=O)Nc2ccc(-c3cccc4c3oc(cc4=O)N3CCOCC3)c3sc4ccccc4c23)CC1
632243	narciclasine	BRD-K06792661	3.30E+01	probe	pilot-set	RHOA	activates cellular activity of RhoA; modulator of Rho/Rho kinase/LIM kinase/cofilin signaling	Sigma-Aldrich	N9789	O[C@H]1C=C2[C@@H](NC(=O)c3c(O)c4OCOc4cc23)[C@H](O)[C@@H]1O
632873	MLN2238	BRD-K78659596	3.30E+01	clinical	pilot-set	PSMB5	inhibitor of 20S proteasome at the chymotrypsin-like proteolytic (beta-5) site	Selleck	S2180	CC(C)C[C@H](NC(=O)CNC(=O)c1cc(Cl)ccc1Cl)B(O)O
632907	ISOX	BRD-K69840642	3.30E+01	probe	chromatin;pilot-set	HDAC6	inhibitor of HDAC6	Axon Medchem;Axon Medchem	Axon 1645;1645	CC(C)(C)OC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO
634309	lapatinib	BRD-K19687926	6.60E+01	FDA	CTEP;kinome;std-of-care	EGFR;ERBB2	inhibitor of EGFR and HER2	Selleck	S1028	CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
634814	BRD-K29313308	BRD-K29313308	6.60E+01	probe	chromatin;outreach	HDAC3	inhibitor of HDAC3	Stanley Center for Psychiatric Research at the Broad Institute		CC(=O)Nc1ccc(cc1)C(=O)Nc1ccc(F)cc1N
635576	UNC0321	BRD-K74236984	3.30E+01	probe	chromatin;pilot-set	EHMT2	inhibitor of G9a histone methyltransferase	Cayman	10582	COc1cc2c(NC3CCN(C)CC3)nc(nc2cc1OCCOCCN(C)C)N1CCCN(C)CC1
635882	SGX-523	BRD-K19477839	6.60E+01	clinical	kinome	MET	inhibitor of MET	Selleck	S1112	Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
636425	erismodegib	BRD-K19796430	3.30E+01	probe	chromatin;pilot-set		screening hit	Selleck	S2151	C[C@H]1CN(C[C@@H](C)O1)c1ccc(NC(=O)c2cccc(-c3ccc(OC(F)(F)F)cc3)c2C)cn1
636711	alisertib	BRD-K75295174	6.60E+01	clinical	CTEP;kinome	AURKA;AURKB	inhibitor of aurora kinases A and B	Selleck	S1133	COc1cc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2OC)ccc1C(O)=O
639390	AZD6482	BRD-K58772419	6.60E+01	clinical	kinome	PIK3CB;PIK3CD	inhibitor of PI3K catalytic subunits beta and delta	Selleck	S1462	C[C@@H](Nc1ccccc1C(O)=O)c1cc(C)cn2c1nc(cc2=O)N1CCOCC1
639450	ruxolitinib	BRD-K53972329	6.60E+01	FDA	kinome;std-of-care	JAK1;JAK2	inhibitor of Janus kinases 1 and 2	Selleck	S1378	N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12
639531	bleomycin A2	BRD-A42083487	6.60E+01	FDA	std-of-care		inducer of DNA damage	Selleck;Calbiochem	S1214;203401-10MG	C[C@@H](O)[C@@H](NC(=O)[C@H](C)[C@@H](O)[C@H](C)NC(=O)[C@@H](NC(=O)c1nc(nc(N)c1C)[C@H](CC(N)=O)NC[C@@H](N)C(N)=O)C(O[C@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](OC(N)=O)[C@@H]1O)c1c[nH]cn1)C(=O)NCCc1nc(cs1)-c1nc(cs1)C(=O)NCCC[S+](C)C
639759	GDC-0941	BRD-K52911425	6.60E+01	clinical	kinome	PIK3CA;PIK3CB;PIK3CD;PIK3CG	inhibitor of PI3K kinase activity	Selleck	S1065	CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
639962	SB-525334	BRD-K37720887	6.60E+01	probe	kinome	TGFBR1	inhibitor of the transforming growth factor beta type 1 receptor	Selleck	S1476	Cc1cccc(n1)-c1[nH]c(nc1-c1ccc2nccnc2c1)C(C)(C)C
640007	PHA-793887	BRD-K64800655	6.60E+01	clinical	chromatin;kinome	CDK1;CDK2;CDK4;CDK5;CDK7;CDK9	inhibitor of cyclin-dependent kinases	Selleck	S1487	CC(C)CC(=O)Nc1n[nH]c2c1CN(C(=O)C1CCN(C)CC1)C2(C)C
640011	quizartinib	BRD-K93918653	6.60E+01	clinical	kinome	FLT3	inhibtor of VEGFR3	Selleck	S1526	CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
640157	fingolimod	BRD-K88025533	6.60E+01	FDA	lit-search	S1PR1	inhibitor of sphingosine 1-phosphate receptor	Selleck	S5002	CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1
640265	pazopanib	BRD-K74514084	6.60E+01	FDA	CTEP;kinome;std-of-care	FLT1;FLT3;KDR;KIT;PDGFRB	inhibitor of VEGFRs, c-KIT, and PDGFRB	Selleck	S1035	CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
640366	WZ4002	BRD-K72420232	3.30E+01	probe	kinome	EGFR	inhibitor of EGFR targeting T790M resistance	Selleck	S1173	COc1cc(ccc1Nc1ncc(Cl)c(Oc2cccc(NC(=O)C=C)c2)n1)N1CCN(C)CC1
641721	BRD-K24690302	BRD-K24690302	6.60E+01	probe	chromatin;outreach	HDAC1	inhibitor of HDAC1	Stanley Center for Psychiatric Research at the Broad Institute		CN(C)CC1CN(C1)C(=O)Nc1cc(ccc1N)-c1ccc(F)cc1
648987	BRD-K70511574	BRD-K62825658	6.60E+01	probe	kinome	PLK1	inhibitor of polo-like kinase 1 (PLK1)	Selleck	S1485	COc1ccc(cc1)S(=O)(=O)N(C(=O)C)c2ccccc2C=Cc3cc[n+]([O-])cc3
649420	PLX-4032	BRD-K56343971	3.30E+01	FDA	kinome;pilot-set;std-of-care	BRAF	inhibitor of BRAF	Selleck;Sequoia Research Products	S1267;S1267	CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F
649754	BRD-K48477130	BRD-K48477130	6.60E+01	probe	lit-search;synthesis		screening hit	Stanley Center for Psychiatric Research at the Broad Institute		Cc1n[nH]c2NC3=C([C@@H](c12)c1ccccc1)C(=O)CC(C)(C)C3
649862	GSK461364	BRD-K92428232	6.60E+01	clinical	kinome	PLK1	inhibitor of polo-like kinase 1 (PLK1)	Selleck	S2193	C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F
651298	YL54	BRD-K58306044	6.60E+01	probe	outreach		stapled helical peptide	Harvard University		CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CCNC(C)=O)C(=O)N[C@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC1=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
651304	BRD-K20514654	BRD-K20514654	6.60E+01	probe	outreach		stapled helical peptide	Harvard University		CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CCNC(C)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC1=O)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
651306	BRD-K55473186	BRD-K57252013	6.60E+01	probe	outreach	NOTCH1	stapled helical peptide targeting NOTCH1	Harvard University		CCC(C)C(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CC(C)C)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCC(=O)O)NC(=O)CCNC(=O)C)C(=O)NC1(C)CCCC=CCCCC(C)(NC(=O)C(CCCNC(=N)N)NC(=O)C(CS)NC(=O)C(CC(C)C)NC1=O)C(=O)NC(Cc2c[nH]cn2)C(=O)NC(Cc3c[nH]cn3)C(=O)NC(CO)C(=O)NC(C(C)O)C(=O)N
651642	BRD-K28456706	BRD-K28456706	6.60E+01	probe	chromatin;lit-search;synthesis	HNF4A	inhibitor of hepatocyte nuclear factor 4 alpha	Broad Institute of MIT and Harvard		Cc1c(oc2ccc3ccccc3c12)[N+]([O-])=O
652975	STF-31	BRD-K22477529	6.60E+01	probe	lit-search;synthesis	NAMPT	inhibitor of nicotinamide phosphoribosyltransferase	Broad Institute of MIT and Harvard		CC(C)(C)c1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)C(=O)Nc1cccnc1
654278	ML334 diastereomer	BRD-K93367411	1.30E+02	probe	lit-search;synthesis	KEAP1;NFE2L2	inhibitor of KEAP1-NFE2L2 protein-protein interaction	Broad Institute of MIT and Harvard		OC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCc2ccccc2[C@H]1CN1C(=O)c2ccccc2C1=O
657183	spautin-1	BRD-K84964099	6.60E+01	probe	lit-search	USP10;USP13	inhibitor of the deubiquitinase activity of USP13 and USP10	Broad Institute of MIT and Harvard		Fc1ccc(CNc2ncnc3ccc(F)cc23)cc1
659226	VAF-347	BRD-K96335988	6.60E+01	probe	lit-search;synthesis	AHR	inhibitor of aryl hydrocarbon receptor	Broad Institute of MIT and Harvard		FC(F)(F)c1ccc(Nc2nccc(n2)-c2cccc(Cl)c2)cc1
659371	BRD-A02303741	BRD-A02303741	5.50E+01	probe	chromatin;lit-search;synthesis	DOT1L	inhibitor of histone methyltransferases	Broad Institute of MIT and Harvard		CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@H]1O[C@H](C(O)[C@H]1O)n1cnc2c(N)ncnc12
659682	ML320	BRD-K81491172	6.60E+01	probe	MLPCN;outreach	GSK3B	inhibitor of GSK3 beta	Broad Institute of MIT and Harvard		COc1ccccc1[C@H]1c2c(NC3=C1C(=O)CC(C)(C)C3)n[nH]c2C(F)(F)F
659993	tigecycline	BRD-A34462049	6.60E+01	FDA	lit-search;outreach		analog of tetracycline	Selleck;Harvard University	S1403	CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(cc(NC(=O)CNC(C)(C)C)c(O)c4C(=O)C3C(=O)[C@]2(O)C(=O)C(C(N)=O)C1=O)N(C)C
660064	BRD-K34099515	BRD-K34099515	6.60E+01	probe	DOS;outreach		screening hit	Broad Institute of MIT and Harvard		CC(C)N1C[C@@H](C)[C@H](CN(C)Cc2ccc(Oc3ccccc3)cc2)Oc2c(NC(=O)c3ccncc3)cccc2C1=O
660073	PF-543	BRD-K79877282	3.30E+01	probe	kinome	SPHK1	inhibitor of sphingosine kinase-1	Pfizer		Cc1cc(CS(=O)(=O)c2ccccc2)cc(OCc2ccc(CN3CCC[C@@H]3CO)cc2)c1
660075	PF-573228	BRD-K79239947	6.60E+01	probe	kinome	PTK2	inhibitor of focal adhesion kinase	Axon Medchem	Axon 1623	CS(=O)(=O)c1cccc(CNc2nc(Nc3ccc4NC(=O)CCc4c3)ncc2C(F)(F)F)c1
660078	ceranib-2	BRD-K31514534	6.60E+01	probe	lit-search	ACER1;ACER2;ACER3;ASAH1;ASAH2;ASAH2B	inhibitor of ceramidase activity	Cayman	11092	COc1ccc(\C=C\C(=O)c2c(-c3ccccc3)c3ccccc3[nH]c2=O)cc1
660079	FSC231	BRD-K24784241	2.70E+02	probe	lit-search	PICK1	inhibitor of PDZ domain of protein interacting with PRKCA 1 (PICK1)	Specs	AH-034/11366495	CCOC(=O)NC(=O)C(=C\c1ccc(Cl)c(Cl)c1)\C#N
660080	968	BRD-A43210826	6.60E+01	probe	lit-search	GLS	inhibitor of glutaminase	Specs	AG-690/36107028	CN(C)c1ccc(cc1Br)C1Nc2ccc3ccccc3c2C2=C1C(=O)CC(C)(C)C2
660081	GSK4112	BRD-K78667050	6.60E+01	probe	lit-search	NR1D1	antagonist of Rev-ErbAalpha	Tocris Bioscience	3663	CC(C)(C)OC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)Cc1ccc(Cl)cc1
660082	etomoxir	BRD-K81335284	3.00E+02	clinical	pilot-set	CPT1A	inhibitor of carnitine palmitoyltransferase	Sigma-Aldrich	E1905	OC(=O)[C@@]1(CCCCCCOc2ccc(Cl)cc2)CO1
660083	HC-067047	BRD-K03391209	6.60E+01	probe	lit-search	TRPV4	inhibitor of cation channel TRPV4	Tocris Bioscience	4100	Cc1c(cc(-c2ccccc2)n1CCCN1CCOCC1)C(=O)Nc1cccc(c1)C(F)(F)F
660084	IPR-456	BRD-A76527075	6.60E+01	probe	lit-search;synthesis	PLAUR	inhibitor of the interaction of urokinase receptor with binding partners	ChemDiv Inc.	C090-0424	CC1CC(C)CN(C1)c1cc(Nc2ccccc2C(O)=O)c2C(=O)c3ccccc3-c3onc1c23
660085	KH-CB19	BRD-K66430217	1.70E+01	probe	kinome	CLK1;CLK4	inhibitor of CDC2-like kinases 1 and 4	Tocris Bioscience	4262	CCOC(=O)c1c(C(=CN)C#N)c2ccc(Cl)c(Cl)c2n1C
660086	leptomycin B	BRD-K27624156	6.60E+01	probe	lit-search	XPO1	inhibitor of exportin 1	LC Laboratories	L-6100	CCC(\C=C\[C@@H]1OC(=O)C=C[C@@H]1C)=C\[C@H](C)C\C=C\C(C)=C\[C@@H](C)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C\C(C)=C\C(O)=O
660087	AZ-3146	BRD-K59146805	6.60E+01	probe	lit-search	TTK	inhibitor of TTK protein kinase	Selleck	S2731	COc1cc(OC2CCN(C)CC2)ccc1Nc1ncc2n(C)c(=O)n(C3CCCC3)c2n1
660119	VU0155056	BRD-K31406481	6.60E+01	probe	lit-search	PLD1;PLD2	inhibitor of phospholipase D1/D2	Avanti Polar Lipids, Inc.	857370P	O=C(NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc2ccccc2c1
660129	JQ-1:UNC0638 (2:1 mol/mol)	BRD-M56714493	5.00E+01	probe	combination	BRDT;EHMT1;EHMT2	inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins;inhibitor of EHMT2 and GLP methyltransferase			Cc1sc-2c(c1C)C(=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n-21)c1ccc(Cl)cc1.COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1OCCCN1CCCC1)C1CCCCC1
660130	carboplatin:UNC0638 (2:1 mol/mol)	BRD-M18136176	5.00E+01	probe	combination	EHMT1;EHMT2	inducer of DNA damage;inhibitor of EHMT2 and GLP methyltransferase			O=C1O[Pt]OC(=O)C11CCC1.COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1OCCCN1CCCC1)C1CCCCC1
660131	vorinostat:carboplatin (1:1 mol/mol)	BRD-M09269305	6.60E+01	probe	combination	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8;inducer of DNA damage			O=C1O[Pt]OC(=O)C11CCC1.ONC(=O)CCCCCCC(=O)Nc1ccccc1
660132	serdemetan:SCH-529074 (1:1 mol/mol)	BRD-M28943608	3.30E+01	probe	combination	MDM2;TP53	inhibitor of MDM2;activator of mutant p53			C(Cc1c[nH]c2ccccc12)Nc1ccc(Nc2ccncc2)cc1.CN(C)CCCNc1nc(CN2CCN(CC2)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)nc2ccccc12
660133	selumetinib:PLX-4032 (8:1 mol/mol)	BRD-M58862563	1.50E+02	probe	combination	MAP2K1;MAP2K2;BRAF	inhibitor of MEK1 and MEK2;inhibitor of BRAF			Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F
660134	sirolimus:bortezomib (250:1 mol/mol)	BRD-M02488208	1.70E+01	probe	combination	MTOR;PSMB1;PSMB2;PSMB5;PSMD1;PSMD2	inhibitor of mTOR;inhibitor of 26S proteasome			CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O.CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1O
660135	BRD-K97651142	BRD-K97651142	6.60E+01	probe	outreach		aphrocallistin derivative	Sanford-Burnham Medical Research Institute		CN(CCc1cc(Br)c(OCCCNc2ncnc3n(C)cnc23)c(Br)c1)C(=O)c1ccc(C)cc1
660136	vorapaxar	BRD-K93442924	6.60E+01	clinical	lit-search	F2R	antagonist of proteinase-activated receptor 1 (PAR1)	Axon Medchem	1755	CCOC(=O)N[C@@H]1CC[C@@H]2[C@H](C[C@@H]3[C@@H]([C@@H](C)OC3=O)[C@H]2\C=C\c2ccc(cn2)-c2cccc(F)c2)C1
660137	Ch-55	BRD-K71487808	6.60E+01	probe	chromatin;lit-search	RARA;RARB;RARG	agonist of retinoid acid receptors	Axon Medchem	1241	CC(C)(C)c1cc(cc(c1)C(C)(C)C)C(=O)\C=C\c1ccc(cc1)C(O)=O
660139	BRD-K79669418	BRD-K79669418	6.60E+01	probe	outreach	MDM2;MDM4	inhibitor of MDM4-p53 interaction	Dana Farber Cancer Institute		CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@](C)(CCCCCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(C)=O)[C@@H](C)O
660140	BRD-K99584050	BRD-K99584050	6.60E+01	probe	outreach		stapled helical peptide	Dana Farber Cancer Institute		CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@@H](NC1=O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
660145	BRD-A71883111	BRD-A71883111	3.30E+01	probe	lit-search	IDH1	putative inhibitor of IDH1 R132H	Broad Institute of MIT and Harvard		Fc1cccc(c1)N(C(C(=O)NC1CCCCC1)c1ccccc1Cl)C(=O)Cc1cccs1
660172	navitoclax:birinapant (1:1 mol/mol)	BRD-M41956198	3.30E+01	probe	combination	BCL2;BCL2L1;BCL2L2;DIABLO;XIAP	inhibitor of BCL2, BCL-xL, and BCL-W;SMAC mimetic; inhibitor of inhibitor of apoptosis proteins (IAPs)			CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](O)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1cc2c(C[C@@H]3C[C@H](O)CN3C(=O)[C@H](CC)NC(=O)[C@H](C)NC)cc(F)cc2[nH]1.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660173	ISOX:bortezomib (250:1 mol/mol)	BRD-M94091398	1.70E+01	probe	combination	HDAC6;PSMB1;PSMB2;PSMB5;PSMD1;PSMD2	inhibitor of HDAC6;inhibitor of 26S proteasome			CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O.CC(C)(C)OC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NCCCCCCC(=O)NO
660174	selumetinib:GDC-0941 (4:1 mol/mol)	BRD-M25329837	1.70E+02	probe	combination	MAP2K1;MAP2K2;PIK3CA;PIK3CB;PIK3CD;PIK3CG	inhibitor of MEK1 and MEK2;inhibitor of PI3K kinase activity			Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO.CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
660175	selumetinib:tretinoin (2:1 mol/mol)	BRD-M45185124	2.00E+02	probe	combination	MAP2K1;MAP2K2;RARA;RARB;RARG	inhibitor of MEK1 and MEK2;agonist of retinoid acid receptors			CC(=C/CO)\C=C\C=C(C)\C=C\C1=C(C)CCCC1(C)C.Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
660176	selumetinib:vorinostat (8:1 mol/mol)	BRD-M98616540	1.50E+02	probe	combination	MAP2K1;MAP2K2;HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of MEK1 and MEK2;inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8			ONC(=O)CCCCCCC(=O)Nc1ccccc1.Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
660177	selumetinib:JQ-1 (4:1 mol/mol)	BRD-M46138460	1.70E+02	probe	combination	MAP2K1;MAP2K2;BRDT	inhibitor of MEK1 and MEK2;inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins			Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO.Cc1sc-2c(c1C)C(=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n-21)c1ccc(Cl)cc1
660178	selumetinib:BRD-A02303741 (4:1 mol/mol)	BRD-M65857522	1.70E+02	probe	combination	MAP2K1;MAP2K2;DOT1L	inhibitor of MEK1 and MEK2;inhibitor of histone methyltransferases			Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO.CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc2c(N)ncnc12
660179	tretinoin:navitoclax (4:1 mol/mol)	BRD-M74379094	8.30E+01	probe	combination	RARA;RARB;RARG;BCL2;BCL2L1;BCL2L2	agonist of retinoid acid receptors;inhibitor of BCL2, BCL-xL, and BCL-W			CC(=C/CO)\C=C\C=C(C)\C=C\C1=C(C)CCCC1(C)C.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660180	decitabine:navitoclax (2:1 mol/mol)	BRD-M43399311	5.00E+01	probe	combination	DNMT1;BCL2;BCL2L1;BCL2L2	inhibitor of DNA methyltransferase;inhibitor of BCL2, BCL-xL, and BCL-W			Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660181	tretinoin:carboplatin (2:1 mol/mol)	BRD-M31706333	1.00E+02	probe	combination	RARA;RARB;RARG	agonist of retinoid acid receptors;inducer of DNA damage			O=C1O[Pt]OC(=O)C11CCC1.CC(\C=C\C=C(C)\C=C\C1=C(C)CCCC1(C)C)=C/CO
660201	necrostatin-7	BRD-K50145167	6.60E+01	probe	lit-search		inhibitor of necroptosis	Cayman	10528	Fc1ccc(cc1)-c1n[nH]cc1C=C1SC(=N)N(C1=O)c1nccs1
660202	PYR-41	BRD-K60750172	6.60E+01	probe	lit-search	UBA1	inhibitor of ubiquitin-activating enzyme in cells	Tocris Bioscience;Tocris Bioscience	4088;2978	CCOC(=O)c1ccc(cc1)N1NC(=O)C(=Cc2ccc(o2)[N+]([O-])=O)C1=O
660206	I-BET151	BRD-K36363294	6.60E+01	probe	chromatin;lit-search	BRD2;BRD3;BRD4	inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins	ChemieTek	CT-BET151 .	COc1cc2c3n([C@H](C)c4ccccn4)c(=O)[nH]c3cnc2cc1-c1c(C)noc1C
660207	lomeguatrib	BRD-K27955832	6.60E+01	clinical	lit-search	MGMT	inhibitor of methylguanine-DNA methyltransferase	Tocris Bioscience	4359	Nc1nc(OCc2cc(Br)cs2)c2[nH]cnc2n1
660208	PF-184	BRD-K11593101	6.60E+01	probe	kinome	IKBKB	inhibitor of IKK-2	Tocris Bioscience	4238	C[C@@]1(CO)CN(C[C@]1(C)CO)c1cc(C(=O)Nc2ccc3CCc4c(nn(c4-c3c2)-c2ccc(F)cc2)C(N)=O)c(Cl)cn1
660216	tanespimycin:gemcitabine (1:1 mol/mol)	BRD-M41695494	3.30E+01	probe	combination	HSP90AA1;CMPK1;RRM1;TYMS	inhibitor of HSP90;inhibitor of DNA replication; inhibitor of ribonucleotide reductase, thymidylate synthetase, and cytidine monophosphate (UMP-CMP) kinase 			Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(=O)n1.CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O
660217	docetaxel:tanespimycin (2:1 mol/mol)	BRD-M60574774	5.00E+01	probe	combination	HSP90AA1	inhibitor of microtubule assembly;inhibitor of HSP90			CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O.CC(=O)O[C@@]12CO[C@@H]1C[C@H](O)[C@]1(C)C2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c3ccccc3)C(C)=C([C@@H](O)C1=O)C2(C)C
660218	selumetinib:MK-2206 (8:1 mol/mol)	BRD-M34300043	1.50E+02	probe	combination	MAP2K1;MAP2K2;AKT1	inhibitor of MEK1 and MEK2;inhibitor of AKT1			Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO.NC1(CCC1)c1ccc(cc1)-c1nc2ccn3c(n[nH]c3=O)c2cc1-c1ccccc1
660219	navitoclax:PLX-4032 (1:1 mol/mol)	BRD-M55709992	3.30E+01	probe	combination	BCL2;BCL2L1;BCL2L2;BRAF	inhibitor of BCL2, BCL-xL, and BCL-W;inhibitor of BRAF			CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660220	selumetinib:piperlongumine (8:1 mol/mol)	BRD-M89326994	1.50E+02	probe	combination	MAP2K1;MAP2K2	inhibitor of MEK1 and MEK2;natural product; modulator of ROS levels			COc1cc(\C=C\C(=O)N2CCC=CC2=O)cc(OC)c1OC.Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
660221	tanespimycin:bortezomib (250:1 mol/mol)	BRD-M09675615	1.70E+01	probe	combination	HSP90AA1;PSMB1;PSMB2;PSMB5;PSMD1;PSMD2	inhibitor of HSP90;inhibitor of 26S proteasome			CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O.CO[C@H]1C[C@H](C)CC2=C(NCC=C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O
660222	navitoclax:MST-312 (1:1 mol/mol)	BRD-M71072276	3.30E+01	probe	combination	BCL2;BCL2L1;BCL2L2;TERT	inhibitor of BCL2, BCL-xL, and BCL-W;inhibitor of telomerase reverse transcriptase			Oc1cccc(C(=O)Nc2cccc(NC(=O)c3cccc(O)c3O)c2)c1O.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660223	carboplatin:etoposide (40:17 mol/mol)	BRD-M63575423	4.80E+01	probe	combination	TOP2A	inducer of DNA damage;inhibitor of topoisomerase II			O=C1O[Pt]OC(=O)C11CCC1.COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](O[C@@H]2O[C@@H]3CO[C@@H](C)O[C@H]3[C@H](O)[C@H]2O)c2cc3OCOc3cc12
660224	piperlongumine:MST-312 (1:1 mol/mol)	BRD-M37545453	3.30E+01	probe	combination	TERT	natural product; modulator of ROS levels;inhibitor of telomerase reverse transcriptase			COc1cc(\C=C\C(=O)N2CCC=CC2=O)cc(OC)c1OC.Oc1cccc(C(=O)Nc2cccc(NC(=O)c3cccc(O)c3O)c2)c1O
660225	navitoclax:gemcitabine (1:1 mol/mol)	BRD-M68535767	3.30E+01	probe	combination	BCL2;BCL2L1;BCL2L2;CMPK1;RRM1;TYMS	inhibitor of BCL2, BCL-xL, and BCL-W;inhibitor of DNA replication; inhibitor of ribonucleotide reductase, thymidylate synthetase, and cytidine monophosphate (UMP-CMP) kinase 			Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)C2(F)F)c(=O)n1.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660227	JW-480	BRD-K99655327	6.60E+01	probe	lit-search	NCEH1	inhibitor of serine hydrolase enzyme NCEH	Tocris Bioscience	4327	CC(C)c1ccccc1OC(=O)NCCc1ccc2ccccc2c1
660228	BMS-195614	BRD-K45935533	6.60E+01	probe	chromatin;lit-search	RARA;RARB;RARG	antagonist of retinoic acid receptors	Tocris Bioscience	3660	CC1(C)CC=C(c2cnc3ccccc3c2)c2cc(ccc12)C(=O)Nc1ccc(cc1)C(O)=O
660229	BRD-K07442505	BRD-K07442505	6.60E+01	probe	outreach	BAX	stapled helical peptide activating BAX	Dana Farber Cancer Institute;Dana Farber Cancer Institute	DFCI-LW13	CCOc1ccccc1N\N=C1C(=O)N(N=C\1C)c1nc(cs1)-c1ccccc1
660230	BRD-K35604418	BRD-K35604418	2.70E+02	probe	outreach	MCL1	inhibitor of MCL1	Dana Farber Cancer Institute		Cc1cs\c(=N/C2CCCCC2)n1\N=C\c1ccc(O)c(O)c1O
660238	SB-743921	BRD-K62358710	3.30E+01	clinical	lit-search	KIF11	inhibitor of kinesin 11	Selleck	S2182	CC(C)[C@H](N(CCCN)C(=O)c1ccc(C)cc1)c1oc2cc(Cl)ccc2c(=O)c1Cc1ccccc1
660245	GSK525762A	BRD-K08109215	6.60E+01	probe	chromatin;lit-search	BRD2;BRD3;BRD4	inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins	EMD Biosciences	401010	CCNC(=O)C[C@@H]1N=C(c2ccc(Cl)cc2)c2cc(OC)ccc2-n2c(C)nnc12
660246	navitoclax:pluripotin (1:1 mol/mol)	BRD-M07227555	3.30E+01	probe	combination	BCL2;BCL2L1;BCL2L2;MAPK1;RASAL1	inhibitor of BCL2, BCL-xL, and BCL-W;promoter of embryonic stem cell self-renewal; inhibitor of Ras-GAP and ERK			CN1C(=O)N(Cc2cnc(Nc3cc(C)nn3C)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660247	JQ-1:carboplatin (1:1 mol/mol)	BRD-M11510342	6.60E+01	probe	combination	BRDT	inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins;inducer of DNA damage			O=C1O[Pt]OC(=O)C11CCC1.Cc1sc-2c(c1C)C(=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n-21)c1ccc(Cl)cc1
660248	selumetinib:navitoclax (8:1 mol/mol)	BRD-M39644375	1.50E+02	probe	combination	MAP2K1;MAP2K2;BCL2;BCL2L1;BCL2L2	inhibitor of MEK1 and MEK2;inhibitor of BCL2, BCL-xL, and BCL-W			Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660249	selumetinib:decitabine (4:1 mol/mol)	BRD-M45217710	1.70E+02	probe	combination	MAP2K1;MAP2K2;DNMT1	inhibitor of MEK1 and MEK2;inhibitor of DNA methyltransferase			Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1.Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO
660250	decitabine:carboplatin (1:1 mol/mol)	BRD-M60251345	6.60E+01	probe	combination	DNMT1	inhibitor of DNA methyltransferase;inducer of DNA damage			O=C1O[Pt]OC(=O)C11CCC1.Nc1ncn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1
660251	SNX-2112:bortezomib (250:1 mol/mol)	BRD-M68452404	1.70E+01	probe	combination	HSP90AA1;HSP90B1;PSMB1;PSMB2;PSMB5;PSMD1;PSMD2	inhibitor of HSP90alpha and HSP90beta;inhibitor of 26S proteasome			CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O.CC1(C)Cc2c(c(nn2-c2ccc(C(N)=O)c(N[C@H]3CC[C@H](O)CC3)c2)C(F)(F)F)C(=O)C1
660252	JQ-1:navitoclax (2:1 mol/mol)	BRD-M87479906	5.00E+01	probe	combination	BRDT;BCL2;BCL2L1;BCL2L2	inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins;inhibitor of BCL2, BCL-xL, and BCL-W			Cc1sc-2c(c1C)C(=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n-21)c1ccc(Cl)cc1.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660253	JQ-1:MK-0752 (1:1 mol/mol)	BRD-M94343540	6.60E+01	probe	combination	BRDT;APH1A;NCSTN;PSEN1;PSENEN	inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins;inhibitor of gamma-secretase			OC(=O)CC[C@H]1CC[C@@](CC1)(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1.Cc1sc-2c(c1C)C(=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n-21)c1ccc(Cl)cc1
660268	BRD-A02303741:navitoclax (2:1 mol/mol)	BRD-M76874421	5.00E+01	probe	combination	DOT1L;BCL2;BCL2L1;BCL2L2	inhibitor of histone methyltransferases;inhibitor of BCL2, BCL-xL, and BCL-W			CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc2c(N)ncnc12.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660269	salermide:PLX-4032 (12:1 mol/mol)	BRD-M86771886	2.20E+02	probe	combination	SIRT1;SIRT2;BRAF	inhibitor of sirtuin 1 and sirtuin 2;inhibitor of BRAF			CC(C(=O)Nc1cccc(c1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F
660270	UNC0638:navitoclax (1:1 mol/mol)	BRD-M97749165	3.30E+01	probe	combination	EHMT1;EHMT2;BCL2;BCL2L1;BCL2L2	inhibitor of EHMT2 and GLP methyltransferase;inhibitor of BCL2, BCL-xL, and BCL-W			COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1OCCCN1CCCC1)C1CCCCC1.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660271	BRD-A02303741:carboplatin (1:1 mol/mol)	BRD-M48845972	6.60E+01	probe	combination	DOT1L	inhibitor of histone methyltransferases;inducer of DNA damage			O=C1O[Pt]OC(=O)C11CCC1.CC(C)N(CCCNC(=O)Nc1ccc(cc1)C(C)(C)C)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc2c(N)ncnc12
660280	doxorubicin:navitoclax (2:1 mol/mol)	BRD-M01915239	5.00E+01	probe	combination	TOP2A;BCL2;BCL2L1;BCL2L2	inhibitor of topoisomerase II;inhibitor of BCL2, BCL-xL, and BCL-W			COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660281	selumetinib:UNC0638 (4:1 mol/mol)	BRD-M39460218	1.70E+02	probe	combination	MAP2K1;MAP2K2;EHMT1;EHMT2	inhibitor of MEK1 and MEK2;inhibitor of EHMT2 and GLP methyltransferase			Cn1cnc2c(F)c(Nc3ccc(Br)cc3Cl)c(cc12)C(=O)NOCCO.COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1OCCCN1CCCC1)C1CCCCC1
660282	alisertib:navitoclax (2:1 mol/mol)	BRD-M07476339	5.00E+01	probe	combination	AURKA;AURKB;BCL2;BCL2L1;BCL2L2	inhibitor of aurora kinases A and B;inhibitor of BCL2, BCL-xL, and BCL-W			COc1cc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2OC)ccc1C(O)=O.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660283	navitoclax:sorafenib (1:1 mol/mol)	BRD-M03799014	5.00E+01	probe	combination	BCL2;BCL2L1;BCL2L2;BRAF;FLT3;KDR;RAF1	inhibitor of BCL2, BCL-xL, and BCL-W;inhibitor of BRAF, CRAF, and VEGFR2			CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)cc2)ccn1.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660284	navitoclax:piperlongumine (1:1 mol/mol)	BRD-M43334969	3.30E+01	probe	combination	BCL2;BCL2L1;BCL2L2	inhibitor of BCL2, BCL-xL, and BCL-W;natural product; modulator of ROS levels			COc1cc(\C=C\C(=O)N2CCC=CC2=O)cc(OC)c1OC.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660286	SMER-3	BRD-K92960067	6.60E+01	probe	lit-search	CUL1;SKP1	inhibitor of E3-ubiquitin ligase	Tocris Bioscience	4375	O=C1c2ccccc2-c2nc3nonc3nc12
660287	NVP-ADW742	BRD-K15179513	6.60E+01	probe	kinome	IGF1R	inhibitor of insulin-like growth factor 1 receptor	Selleck	S1088	Nc1ncnc2n(cc(-c3cccc(OCc4ccccc4)c3)c12)[C@H]1C[C@H](CN2CCCC2)C1
660288	clofarabine	BRD-K34022604	6.60E+01	FDA	std-of-care		inducer of DNA damage	Selleck	S1218	Nc1nc(Cl)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F
660301	vorinostat:navitoclax (4:1 mol/mol)	BRD-M23798888	3.30E+01	probe	combination	HDAC1;HDAC2;HDAC3;HDAC6;HDAC8;BCL2;BCL2L1;BCL2L2	inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8;inhibitor of BCL2, BCL-xL, and BCL-W			ONC(=O)CCCCCCC(=O)Nc1ccccc1.CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1
660304	XL765	BRD-K75308783	6.60E+01	clinical	kinome	MTOR;PIK3CA;PIK3CB;PIK3CD;PIK3CG;PRKDC	inhibitor of mTOR and PI3K kinase acitivities	Selleck	S1523	COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccc(NC(=O)c3ccc(C)c(OC)c3)cc2)cc(OC)c1
660306	AZD1480	BRD-K65928735	6.60E+01	clinical	CTEP;kinome	JAK1;JAK2	inhibitor of Janus kinases 1 and 2	Selleck	S2162	C[C@H](Nc1ncc(Cl)c(Nc2cc(C)[nH]n2)n1)c1ncc(F)cn1
660314	ML258	BRD-A82720512	6.60E+01	probe	outreach	BCL2L10	inhibitor of BIM-BCL-B interaction	Sanford-Burnham Medical Research Institute		COc1ccc(CN2c3nnnn3C3C(C2=O)C2(CCCC2)Cc2ccccc32)cc1
660317	SR1001	BRD-K47981327	6.60E+01	probe	chromatin;lit-search	RORA;RORC	synthetic ROR ligand; suppressor of TH17 differentiation	Cayman	10922	CC(=O)Nc1nc(C)c(s1)S(=O)(=O)Nc1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F
660318	bardoxolone methyl	BRD-K59437938	6.60E+01	clinical	lit-search		electrophilic inducer of the NFE2L2-KEAP1 pathway	Axon Medchem	1772	COC(=O)[C@@]12CCC(C)(C)C[C@@H]1[C@@H]1C(=O)C=C3[C@]4(C)C=C(C#N)C(=O)C(C)(C)[C@H]4CC[C@]3(C)[C@@]1(C)CC2
660319	elocalcitol	BRD-A04287157	6.60E+01	clinical	lit-search	VDR	agonist of vitamin D receptor	Axon Medchem	1676	CCC(O)(CC)\C=C\CC(C)C1=CC[C@@H]2[C@]1(C)CCC\C2=C/C=C1/C[C@@H](O)C[C@H](F)C1=C
660321	BMS-270394	BRD-K04905989	6.60E+01	probe	chromatin;lit-search	RARG	antagonist of retinoic acid receptor gamma	Axon Medchem	1173	CC1(C)CCC(C)(C)c2cc(ccc12)[C@@H](O)C(=O)Nc1ccc(cc1F)C(O)=O
660322	fluvastatin	BRD-A52530402	6.60E+01	FDA	lit-search	HMGCR	inhibitor of HMG-CoA reductase	Tocris Bioscience	3309	CC(C)N1C(\C=C\C(O)CC(O)CC(O)=O)C(c2ccccc12)c1ccc(F)cc1
660325	AZD4547	BRD-K28392481	6.60E+01	clinical	lit-search	FGFR1;FGFR2;FGFR3	inhibitor of fibroblast growth factor receptors	Active Biochem	A-1174	COc1cc(CCc2cc(NC(=O)c3ccc(cc3)N3C[C@H](C)N[C@H](C)C3)n[nH]2)cc(OC)c1
660327	hyperforin	BRD-A30032852	6.60E+01	clinical	lit-search	TRPC6	agonist of calcium-permeable ion channels	Sigma-Aldrich	H1792	CC(C)C(=O)[C@@]12C(=O)C(CC=C(C)C)C(=O)C(CC=C(C)C)(C[C@H](CC=C(C)C)[C@@]1(C)CCC=C(C)C)C2=O
660331	NVP-231	BRD-A12571627	6.60E+01	probe	kinome	CERK	inhibitor of ceramide kinase	Tocris Bioscience	3960	O=C(Nc1nc2ccc(NC(=O)C34C[C@H]5C[C@H](C[C@H](C5)C3)C4)cc2s1)c1ccccc1
660332	MK-0752	BRD-K18850819	6.60E+01	clinical	lit-search	APH1A;NCSTN;PSEN1;PSENEN	inhibitor of gamma-secretase	Selleck	S2660	OC(=O)CC[C@H]1CC[C@@](CC1)(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1
660341	semagacestat	BRD-K65592642	6.60E+01	clinical	lit-search	APH1A;NCSTN;PSEN1;PSENEN	inhibitor of gamma-secretase	Selleck	S1594	CC(C)[C@H](O)C(=O)N[C@@H](C)C(=O)N[C@H]1c2ccccc2CCN(C)C1=O
660342	BRD-A05715709	BRD-A05715709	6.60E+01	probe	outreach	IDH1	putative inhibitor of IDH1 R132H	Broad Institute of MIT and Harvard		Cc1ccccc1C(N(C(=O)Cc1ccncc1)c1cccc(F)c1)C(=O)NC1CCCCC1
660346	bosutinib	BRD-K90746395	6.60E+01	FDA	kinome	ABL1;SRC	inhibitor of SRC and ABL1	Selleck	S1014	COc1cc(Nc2cc(nc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
660358	temsirolimus	BRD-K08177763	6.60E+01	FDA	CTEP;kinome;std-of-care	MTOR	inhibitor of mTOR	Selleck	S1044	CO[C@@H]1C[C@H](C[C@@H](C)[C@@H]2CC(=O)[C@H](C)\C=C(C)\[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)\C=C\C=C\C=C(C)\[C@H](C[C@@H]3CC[C@@H](C)[C@@](O)(O3)C(=O)C(=O)N3CCCC[C@H]3C(=O)O2)OC)CC[C@H]1OC(=O)C(C)(CO)CO
660363	abiraterone	BRD-K50071428	1.70E+01	FDA	std-of-care	CYP17A1	inhibitor of 17 alpha-hydroxylase and C17,20 lyase	Selleck	S1123	C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC=C2c1cccnc1
660364	docetaxel	BRD-A05821830	6.60E+01	FDA	std-of-care		inhibitor of microtubule assembly	Selleck	S1148	CC(=O)O[C@@]12CO[C@@H]1C[C@H](O)[C@]1(C)C2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)OC(C)(C)C)c3ccccc3)C(C)=C([C@@H](O)C1=O)C2(C)C
660391	nelarabine	BRD-K84466663	6.60E+01	FDA	CTEP;std-of-care	POLA1	deoxyguanosine analog; inhibitor of DNA synthesis	Selleck	S1213	COc1nc(N)nc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O
660397	rigosertib	BRD-K55187425	6.60E+01	clinical	kinome	PIK3CA;PIK3CB;PLK1	inhibitor of polo-like kinase 1; inhibitor of PI3K catalytic subunits alpha and beta	Selleck	S1362	COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(NCC(O)=O)c2)c(OC)c1
660409	AT7867	BRD-K12040459	6.60E+01	probe	chromatin;kinome	AKT1;AKT2;AKT3;RPS6KB2	inhibitor of AKT1/2/3 and S6K	Selleck	S1558	Clc1ccc(cc1)C1(CCNCC1)c1ccc(cc1)-c1cn[nH]c1
660410	PD318088	BRD-A57798112	6.60E+01	probe	kinome	MAP2K1;MAP2K2	inhibitor of MEK1 and MEK2	Selleck	S1568	OCC(O)CONC(=O)c1cc(Br)c(F)c(F)c1Nc1ccc(I)cc1F
660411	KU-60019	BRD-K36016295	6.60E+01	probe	kinome	ATM	inhibitor of ataxia telangiectasia mutated (ATM)	Selleck	S1570	C[C@H]1CN(CC(=O)Nc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C[C@@H](C)O1
660412	BIRB-796	BRD-K74065929	6.60E+01	probe	kinome	MAPK11;MAPK11;MAPK14	inhibitor of p38 MAPK	Selleck	S1574	Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
660413	KW-2449	BRD-K21718444	6.60E+01	clinical	kinome	AURKA;FLT3	inhibitor of FLT3 and AURKA	Selleck	S2158	O=C(N1CCNCC1)c1ccc(cc1)\C=C\c1n[nH]c2ccccc12
660414	RAF265	BRD-K93123848	6.60E+01	clinical	kinome	BRAF;KDR	ihibitor of VEGFR2 and BRAF	Selleck	S2161	Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
660421	silmitasertib	BRD-K81458380	6.60E+01	clinical	kinome	CSNK2A1;CSNK2A2	inhibitor of casein kinase 2	Selleck	S2248	OC(=O)c1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1ccncc21
660424	BRD-K03911514	BRD-K03911514	6.60E+01	probe	outreach		stapled helical peptide	Dana Farber Cancer Institute		CCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
660425	BRD-K16130065	BRD-K16130065	6.60E+01	probe	outreach		stapled helical peptide	Dana Farber Cancer Institute		CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@@H](NC1=O)[C@@H](C)CC)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
660429	momelotinib	BRD-K87737963	6.60E+01	clinical	kinome	JAK1;JAK2	inhibitor of Janus kinases 1 and 2	Selleck	S2219	O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
660430	CAL-101	BRD-K60866521	6.60E+01	clinical	kinome	PIK3CD	inhibitor of PI3K catalytic subunit delta	Selleck	S2226	CC[C@H](Nc1ncnc2[nH]cnc12)c1nc2cccc(F)c2c(=O)n1-c1ccccc1
660431	LY-2157299	BRD-K78118466	6.60E+01	probe	kinome	TGFBR1	inhibitor of the transforming growth factor beta type 1 receptor	Selleck	S2230	Cc1cccc(n1)-c1nn2CCCc2c1-c1ccnc2ccc(cc12)C(N)=O
660432	WP1130	BRD-K43644456	6.60E+01	probe	lit-search	UCHL5;USP14;USP5;USP9X	inhibitor of the deubiquitinase activity of USP9X, USP5, USP14, and UCH37	Selleck	S2243	CCC[C@H](NC(=O)C(=C\c1cccc(Br)n1)\C#N)c1ccccc1
660433	OSI-027	BRD-K87124298	6.60E+01	clinical	lit-search	MTOR	inhibitor of mTORC1 and mTORC2	Selleck	S2624	COc1cccc2cc([nH]c12)-c1nc([C@H]2CC[C@@H](CC2)C(O)=O)n2ncnc(N)c12
660434	NVP-BSK805	BRD-K02017404	6.60E+01	probe	kinome	JAK2	inhibitor of Janus kinase 2	Selleck	S2686	Fc1cc(cc(F)c1CN1CCOCC1)-c1cccc2ncc(nc12)-c1cnn(c1)C1CCNCC1
660768	erlotinib:PLX-4032 (2:1 mol/mol)	BRD-M27152968	5.00E+01	probe	combination	EGFR;ERBB2;BRAF	inhibitor of EGFR and HER2;inhibitor of BRAF			COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F
660774	PIK-93	BRD-K29395450	6.60E+01	probe	kinome	PIK3CG	inhibitor of PI3K catalytic subunit gamma	Selleck	S1489	CC(=O)Nc1nc(C)c(s1)-c1ccc(Cl)c(c1)S(=O)(=O)NCCO
660777	AZD7762	BRD-K86525559	6.60E+01	clinical	kinome	CHEK1;CHEK2	inhibitor of checkpoint kinases 1 and 2	Selleck	S1532	NC(=O)Nc1cc(sc1C(=O)N[C@H]1CCCNC1)-c1cccc(F)c1
660778	birinapant	BRD-K18589165	6.60E+01	clinical	CTEP;lit-search	DIABLO;XIAP	SMAC mimetic; inhibitor of inhibitor of apoptosis proteins (IAPs)	Active Biochem	A-1901	CC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](O)C[C@H]1Cc1c([nH]c2cc(F)ccc12)-c1cc2c(C[C@@H]3C[C@H](O)CN3C(=O)[C@H](CC)NC(=O)[C@H](C)NC)cc(F)cc2[nH]1
660779	KX2-391	BRD-K29968218	6.60E+01	clinical	kinome	SRC	peptide mimetic; inhibitor of SRC activity in cells	Selleck	S2700	O=C(Cc1ccc(cn1)-c1ccc(OCCN2CCOCC2)cc1)NCc1ccccc1
660796	3-Cl-AHPC	BRD-A09890259	6.60E+01	probe	outreach	NR0B2	binder of nuclear receptor SHP	Sanford-Burnham Medical Research Institute		OC(=O)\C=C\c1ccc(c(Cl)c1)-c1ccc(O)c(c1)C12C[C@H]3C[C@H](C[C@H](C3)C1)C2
660797	BRD-K58730230	BRD-K58730230	6.60E+01	probe	outreach		stapled helical peptide	Dana Farber Cancer Institute		CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
660798	BRD-K27188169	BRD-K27188169	6.60E+01	probe	outreach		stapled helical peptide	Dana Farber Cancer Institute		CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
660819	KHS101	BRD-K78978711	6.60E+01	probe	lit-search	TACC3	binder of TACC3, a component of the centrosome and mitotic spindle	Sigma-Aldrich	K4019	CC(C)CNc1ccnc(NCc2csc(n2)-c2ccccc2)n1
660821	WAY-362450	BRD-K54640016	6.60E+01	probe	chromatin;lit-search	NR1H4	agonist of farnesoid X receptor	Axon Medchem	1749	CC(C)OC(=O)C1=CN(CC(C)(C)c2c1[nH]c1ccccc21)C(=O)c1ccc(F)c(F)c1
660823	JQ-1:vorinostat (2:1 mol/mol)	BRD-M56962220	5.00E+01	probe	combination	BRDT;HDAC1;HDAC2;HDAC3;HDAC6;HDAC8	inhibitor of bromodomain (BRD) and extra-C terminal domain (BET) proteins;inhibitor of HDAC1, HDAC2, HDAC3, HDAC6, and HDAC8			ONC(=O)CCCCCCC(=O)Nc1ccccc1.Cc1sc-2c(c1C)C(=N[C@@H](CC(=O)OC(C)(C)C)c1nnc(C)n-21)c1ccc(Cl)cc1
660839	BRD-K13185470	BRD-K13185470	6.60E+01	probe	outreach	MCL1	stapled helical peptide targeting MCL1	Dana Farber Cancer Institute		CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
660840	cabozantinib	BRD-K51544265	6.60E+01	FDA	CTEP;kinome	FLT3;KDR;MET;RET	inhibitor of c-MET, VEGFR2/3, and RET	Selleck	S1119	COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC
660857	crizotinib:PLX-4032 (2:1 mol/mol)	BRD-M95284333	5.00E+01	probe	combination	ALK;MET;BRAF	inhibitor of c-MET and ALK;inhibitor of BRAF			C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F
660890	BRD-M00053801	BRD-M00053801	6.60E+01	probe	lit-search;synthesis	BCL2	inhibitor of BCL2	Broad Institute of MIT and Harvard		C[C@H](O)[C@@H]1[C@H](CO)ON(Cc2cccc(CN(CCN(C)C)[C@H](C3CCCCC3)c3ccccc3)c2)[C@@H]1C(=O)N[C@H]1C[C@H]2C[C@@H]([C@@H]1C)C2(C)C.C[C@H](O)[C@@H]1[C@H](CO)ON(Cc2cccc(CN(CCN(C)C)[C@@H](C3CCCCC3)c3ccccc3)c2)[C@@H]1C(=O)N[C@H]1C[C@H]2C[C@@H]([C@@H]1C)C2(C)C
660935	KPT185	BRD-K71467466	6.60E+01	probe	outreach	XPO1	inhibitor of exportin 1	Karyopharm Therapeutics	KPT-185-004	COc1cc(cc(c1)C(F)(F)F)-c1ncn(\C=C/C(=O)OC(C)C)n1
660985	pitstop2	BRD-K90570971	6.60E+01	probe	lit-search	CLTA;CLTB;CLTC;CLTCL1	inhibitor of clathrin and clathrin-independent endocytosis	Cellagen Technology	C7487-2	Brc1ccc(cc1)\C=C1/SC(NS(=O)(=O)c2cccc3ccccc23)=NC1=O
660993	R428	BRD-K14870255	6.60E+01	probe	kinome	AXL	inhibitor of the tyrosine-protein kinase receptor UFO	Symansis Cell Signaling Science	SY-R428/10	Nc1nc(Nc2ccc3CC[C@@H](CCc3c2)N2CCCC2)nn1-c1cc2CCCc3ccccc3-c2nn1
660994	ibrutinib	BRD-K70301465	6.60E+01	clinical	CTEP;kinome	BTK	inhibitor of Bruton's tyrosine kinase	Selleck	S2680	Nc1ncnc2n(nc(-c3ccc(Oc4ccccc4)cc3)c12)[C@@H]1CCCN(C1)C(=O)C=C
661032	sotrastaurin	BRD-K16761703	6.60E+01	clinical	kinome	PRKCB	inhibitor of protein kinase C beta	Axon Medchem	1635	CN1CCN(CC1)c1nc(C2=C(C(=O)NC2=O)c2c[nH]c3ccccc23)c2ccccc2n1
661033	A-804598	BRD-K76894955	6.60E+01	probe	lit-search	P2RX7	inhibitor of purinergic receptor P2X	Tocris Bioscience	4473	C[C@H](\N=C(\NC#N)Nc1cccc2ncccc12)c1ccccc1
665818	BRD-K27188169:navitoclax (2:1 mol/mol)	BRD-M23096439	5.00E+01	probe	combination	BCL2;BCL2L1;BCL2L2	stapled helical peptide;inhibitor of BCL2, BCL-xL, and BCL-W			CC1(C)CCC(=C(CN2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(N[C@H](CCN3CCOCC3)CSc3ccccc3)c(c2)S(=O)(=O)C(F)(F)F)C1)c1ccc(Cl)cc1.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@@]1(C)CCC\C=C/CCC[C@](C)(NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
665914	COL-3	BRD-A59431241	6.60E+01	clinical	outreach		analog of tetracycline	Harvard University		NC(=O)C1C(=O)C[C@@H]2C[C@@H]3Cc4cccc(O)c4C(=O)C3C(=O)[C@]2(O)C1=O
666541	ABT-199	BRD-K62391742	6.60E+01	clinical	lit-search	BCL2	inhibitor of BCL2	Active Biochem	A-1231	CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NCC4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc4[nH]ccc4c3)c2)=C(C1)c1ccc(Cl)cc1
666716	ETP-46464	BRD-K24556407	6.60E+01	probe	lit-search	ATM;ATR	inhibitor of serine/threonine-protein kinase ATR	Spanish National Cancer Research Centre		CC(C)(C#N)c1ccc(cc1)N1C(=O)OCc2cnc3ccc(cc3c12)-c1cnc2ccccc2c1
666910	marinopyrrole A	BRD-K57261999	6.60E+01	probe	outreach	MCL1	natural product; putative inhibitor of MCL1	Harvard University		Oc1ccccc1C(=O)c1[nH]c(Cl)c(Cl)c1-n1c(cc(Cl)c1Cl)C(=O)c1ccccc1O
667933	methylstat	BRD-K52560704	6.60E+01	probe	chromatin;lit-search;outreach	KDM3A;KDM4A;KDM4B;KDM4C;KDM4D	inhibitor of lysine specific demethylases	Colorado State University		COC(=O)\C=C\C(=O)N(O)CCCCNCc1ccc(COC(=O)Nc2cccc3ccccc23)cc1
668495	BYL-719	BRD-K54997624	6.60E+01	clinical	kinome	PIK3CA	inhibitor of PI3K catalytic subunit alpha	Active Biochem	A-1214	Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(c1)C(C)(C)C(F)(F)F
668723	GSK2636771	BRD-K49215523	6.60E+01	clinical	kinome	PIK3CB	inhibitor of PI3K catalytic subunit beta	Active Biochem	A-1230	Cc1nc2c(cc(cc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(O)=O
668858	SR8278	BRD-A02904414	6.60E+01	probe	lit-search	NR1D1	antagonist of Rev-ErbAalpha	EMD Biosciences	EMB-5547	CCOC(=O)C1Cc2ccccc2CN1C(=O)c1ccc(SC)s1
676728	JW-74	BRD-K75664313	6.60E+01	probe	lit-search		inhibitor of WNT signaling	Sigma-Aldrich	SML0227	COc1ccc(cc1)-n1c(SCc2nc(no2)-c2ccc(C)cc2)nnc1-c1ccncc1
677522	necrosulfonamide	BRD-K64117221	6.60E+01	probe	lit-search		inhibitor of downstream signaling of RIP3 associated with MLKL	Toronto Research Chemicals	N388600	COc1nccnc1NS(=O)(=O)c1ccc(NC(=O)\C=C\c2ccc(s2)[N+]([O-])=O)cc1
679843	HBX-41108	BRD-K50501969	6.60E+01	probe	lit-search	USP7	inhibitor of the deubiquitinase activity of USP7	Tocris Bioscience	4285	Clc1ccc-2c(c1)C(=O)c1nc(C#N)c(nc-21)C#N
679844	palmostatin B	BRD-K42137908	6.60E+01	probe	lit-search	LYPLA1	inhibitor of acyl-protein thioesterase 1	EMD Biosciences	178501	CCCCCCCCCC[C@H]1[C@H](CCc2ccc(OC)c(OC)c2)OC1=O
682993	JW-55	BRD-K53328210	6.60E+01	probe	lit-search	TNKS	inhibitor of tankyrase	ChemBridge Corporation	7667791	COc1ccc(cc1)C1(CNC(=O)c2ccc(NC(=O)c3ccco3)cc2)CCOCC1
686134	BRD-K03536150	BRD-K03536150	2.70E+02	probe	outreach	BAX	activator of BAX	Dana Farber Cancer Institute;Dana Farber Cancer Institute	DFCI-LW14	CC1=NN(C(=O)C\1=N\Nc1ccccc1C(O)=O)c1nc(cs1)-c1ccccc1
687395	BRD-K99006945	BRD-K99006945	6.60E+01	probe	chromatin;lit-search;synthesis		screening hit	Broad Institute of MIT and Harvard		CCN(CC)c1ccc(cc1)C1=NNC(=O)C[C@H]1C
687406	tivantinib	BRD-K33379087	6.60E+01	clinical	CTEP;kinome	MET	inhibitor of MET; inhibitor of microtubule assembly	Active Biochem	A-1109	O=C1NC(=O)[C@H]([C@@H]1c1c[nH]c2ccccc12)c1cn2CCCc3cccc1c23
687418	trametinib	BRD-K12343256	6.60E+01	clinical	CTEP;kinome	MAP2K1;MAP2K2	inhibitor of MEK1 and MEK2	Selleck	S2673	CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O
687577	RO4929097	BRD-K22024824	6.60E+01	clinical	CTEP	APH1A;NCSTN;PSEN1;PSENEN	inhibitor of gamma-secretase	Selleck	S1575	CC(C)(C(=O)NCC(F)(F)C(F)(F)F)C(=O)N[C@H]1c2ccccc2-c2ccccc2NC1=O
687578	dinaciclib	BRD-K13662825	6.60E+01	clinical	chromatin;CTEP;kinome	CDK1;CDK2;CDK5;CDK9	inhibitor of cyclin-dependent kinases	Selleck	S2678	CCc1cnn2c(NCc3ccc[n+]([O-])c3)cc(nc12)N1CCCC[C@H]1CCO
687579	MLN2480	BRD-K43410529	6.60E+01	clinical	lit-search	ARAF;BRAF;RAF1	inhibitor of RAF kinases	Active Biochem	A-1192	C[C@@H](NC(=O)c1ncnc(N)c1Cl)c1ncc(s1)C(=O)Nc1cc(c(Cl)cn1)C(F)(F)F
687661	BRD-K51831558	BRD-K51831558	6.60E+01	probe	chromatin;lit-search;synthesis	EZH2	inhibitor of enhancer of zeste polycomb repressive complex 2 subunit	Broad Institute of MIT and Harvard		CC(C)n1ncc2c(cc(Br)cc12)C(=O)NCc1c(C)cc(C)[nH]c1=O
687694	istradefylline	BRD-K87774949	3.30E+01	clinical	lit-search	ADORA2A	antagonist of the adenosine A2A receptor	Selleck	S2790	CCn1c2nc(\C=C\c3ccc(OC)c(OC)c3)n(C)c2c(=O)n(CC)c1=O
687714	MI-2	BRD-K90860366	6.60E+01	probe	chromatin;lit-search;synthesis	MEN1	binder of menin; inhibitor of menin-MLL fusion protein	Broad Institute of MIT and Harvard		CCCc1cc2c(ncnc2s1)N1CCN(CC1)C1=NCC(C)(C)S1
687715	BRD-K42260513	BRD-K42260513	6.60E+01	probe	chromatin;lit-search;synthesis	EZH2	inhibitor of enhancer of zeste polycomb repressive complex 2 subunit	Broad Institute of MIT and Harvard		CC(C)n1ncc2c(cc(cc12)-c1ccc(nc1)N1CCNCC1)C(=O)NCc1c(C)cc(C)[nH]c1=O
687720	alvocidib	BRD-K68682020	6.60E+01	clinical	CTEP;kinome	CDK1;CDK2;CDK4;CDK6	inhibitor of cyclin-dependent kinases	Selleck	S1230	CN1CC[C@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl
687721	CBB-1007	BRD-K84754008	6.60E+01	probe	lit-search	KDM1A	inhibitor of lysine-specific demethylase 1A (LSD1)	Broad Institute of MIT and Harvard		COC(=O)c1cc(CN2CCN(CC2)C(N)=N)cc(c1)C(=O)N1CCN(CC1)C(=O)c1ccc(cc1)C(N)=N
687735	GSK-J4	BRD-K98203492	6.60E+01	probe	chromatin;lit-search	KDM6A;KDM6B	inhibitor of lysine-specific demethylases	Tocris Bioscience	4594	CCOC(=O)CCNc1cc(nc(n1)-c1ccccn1)N1CCc2ccccc2CC1
687769	BRD-A86708339	BRD-A86708339	6.60E+01	probe	outreach		screening hit	Dana Farber Cancer Institute		Cc1ccc(cc1)C(NC(=O)c1ccccc1)c1ccc2cccnc2c1O
687953	PF-3758309	BRD-K37764012	6.60E+01	probe	kinome	PAK4	inhibitor of serine/threonine p21-activating kinase 4	Broad Institute of MIT and Harvard		CN(C)C[C@@H](NC(=O)N1Cc2c(Nc3nc(C)nc4ccsc34)n[nH]c2C1(C)C)c1ccccc1
687954	dabrafenib	BRD-K09951645	6.60E+01	clinical	CTEP;kinome	BRAF	inhibitor of BRAF	Active Biochem	A-1219	CC(C)(C)c1nc(c(s1)-c1ccnc(N)n1)-c1cccc(NS(=O)(=O)c2c(F)cccc2F)c1F
688138	SZ4TA2	BRD-K55125219	6.60E+01	probe	lit-search	BCL2L1	inhibitor of BCL-xL	Broad Institute of MIT and Harvard		CC1(C)CCN(CC1)c1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(NCCSc2ccccc2)c(c1)[N+]([O-])=O
688229	AT13387	BRD-K58435339	6.60E+01	clinical	CTEP	HSP90AA1	inhibitor of HSP90	Selleck	S1163	CC(C)c1cc(C(=O)N2Cc3ccc(CN4CCN(C)CC4)cc3C2)c(O)cc1O
688516	BCL-LZH-4	BRD-A68258842	6.60E+01	probe	lit-search;synthesis		inhibitor of BCL2, BCL-xL, and MCL1	Broad Institute of MIT and Harvard		COc1ccc(cc1)C1C(C(=O)Nc2ccccc2)=C(C)N=c2s\c(=C/c3cn(Cc4ccccc4)c4ccccc34)c(=O)n12
688799	skepinone-L	BRD-K83607951	6.60E+01	probe	kinome	MAPK14	inhibitor of p38 MAPK	Broad Institute of MIT and Harvard		OC[C@@H](O)COc1ccc2CCc3cc(Nc4ccc(F)cc4F)ccc3C(=O)c2c1
688888	BRD-K34222889	BRD-K34222889	6.60E+01	probe	outreach		analog of the natural product piperlongumine	Broad Institute of MIT and Harvard		COc1ccc(cc1)C#CC1=CCCN(C(=O)\C=C\c2cc(OC)c(OC)c(OC)c2)C1=O
688962	PF-4800567 hydrochloride	BRD-K43428468	6.60E+01	probe	kinome	CSNK1D;CSNK1E	inhibitor of casein kinase isoforms delta and epsilon	Tocris Bioscience	4281	Nc1ncnc2n(nc(COc3cccc(Cl)c3)c12)C1CCOCC1
688975	avicin D	BRD-A15100685	6.60E+01	probe	outreach		natural product	MD Anderson Cancer Center		CC1O[C@@H](OCC2O[C@@H](O[C@H]3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C4C6CC(C)(C)[C@H](C[C@@]6([C@H](O)C[C@@]54C)C(=O)O[C@@H]4OC(CO)[C@@H](O)[C@@H](O)[C@@H]4O[C@@H]4OC(C)[C@H](O[C@@H]5O[C@@H](CO)[C@H](O)[C@@H]5O)[C@@H](O[C@@H]5OC(CO)[C@@H](O)[C@@H](O)[C@@H]5O)[C@@H]4O)OC(=O)C(\CO)=C\CC[C@](C)(O[C@@H]4OC(C)[C@@H](OC(=O)C(\CO)=C\CCC(C)(O)C=C)[C@@H](O)[C@@H]4O)C=C)C3(C)C)[C@@H](NC(C)=O)[C@H](O)[C@@H]2O)[C@@H](O[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H]1O
689136	BRD9876:MK-1775 (4:1 mol/mol)	BRD-M80099012	6.60E+01	probe	combination	WEE1	screening hit;inhibitor of WEE1			CC(C)(C)c1ccc2cc(C#N)c(cc2c1)C#N.CN1CCN(CC1)c1ccc(Nc2ncc3c(n2)n(-c2cccc(n2)C(C)(C)O)n(CC=C)c3=O)cc1
689506	BRD-K30748066	BRD-K30748066	6.60E+01	probe	kinome	CDK9	inhibitor of CDK9	Broad Institute of MIT and Harvard		Cc1c(sc(=O)n1C)-c1ccnc(Nc2ccc(cc2)N2CCNCC2)n1
705300	linsitinib	BRD-K08589866	3.30E+01	clinical	CTEP;kinome;pilot-set	IGF1R;INSR	inhibitor of insulin-like growth factor 1 receptor and insulin receptor	Selleck	S1091	CC1(O)CC(C1)c2nc(c3ccc4ccc(nc4c3)c5ccccc5)c6c(N)nccn26
710154	AT-406	BRD-K02834582	6.60E+01	probe	lit-search;synthesis	XIAP	SMAC mimetic; inhibitor of inhibitor of apoptosis proteins (IAPs)	Selleck	S2754	CNC(C)C(=O)NC1CN(CCC2CCC(N2C1=O)C(=O)NC(c3ccccc3)c4ccccc4)C(=O)CC(C)C
