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Q9UKE5 | TNIK_HUMAN | TRAF2 and NCK-interacting protein kinase (TNIK)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4760558 OBDepict N N H S O O CH 3 N H N N H O IC50 = 0.12 nM 471.54 CS(=O)(=O)Nc1cc(C#N)cc(-c2c[nH]c3ncc(-c4cccc(C(=O)NC5CC5)c4)cc23)c1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4749291 OBDepict N HN S O O H 3 C N H N N N H 3 C IC50 = 0.13 nM 500.63 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5cc(C#N)cc(NS(C)(=O)=O)c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4762464 OBDepict N HN S O O H 3 C N H N N H O H 3 C IC50 = 0.18 nM 445.5 CNC(=O)c1cccc(-c2cnc3[nH]cc(-c4cc(C#N)cc(NS(C)(=O)=O)c4)c3c2)c1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4759123 OBDepict N HN S O O N H N N N H 3 C IC50 = 0.19 nM 526.67 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5cc(C#N)cc(NS(=O)(=O)C6CC6)c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4751494 OBDepict N HN S O O H 3 C N H N N O N H 3 C IC50 = 0.21 nM 514.61 CN1CCN(C(=O)c2ccc(-c3cnc4[nH]cc(-c5cc(C#N)cc(NS(C)(=O)=O)c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4744045 OBDepict N NH S O O CH 3 N H N N O IC50 = 0.21 nM 485.57 CS(=O)(=O)Nc1cc(C#N)cc(-c2c[nH]c3ncc(-c4cccc(C(=O)N5CCCC5)c4)cc23)c1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4788405 OBDepict N NH S O O CH 3 N H N N O IC50 = 0.22 nM 499.6 CS(=O)(=O)Nc1cc(C#N)cc(-c2c[nH]c3ncc(-c4cccc(C(=O)N5CCCCC5)c4)cc23)c1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4788976 OBDepict N N H S O O CH 3 N H N N O N CH 3 H 3 C IC50 = 0.22 nM 528.64 CN(C)C1CCN(C(=O)c2cccc(-c3cnc4[nH]cc(-c5cc(C#N)cc(NS(C)(=O)=O)c5)c4c3)c2)C1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4797452 OBDepict N N H N N H N N N CH 3 IC50 = 0.23 nM 447.55 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5cc(C#N)c6[nH]ncc6c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4791330 OBDepict N HN S O O H 3 C N H N N O N H 3 C IC50 = 0.25 nM 514.61 CN1CCN(C(=O)c2cccc(-c3cnc4[nH]cc(-c5cc(C#N)cc(NS(C)(=O)=O)c5)c4c3)c2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4756005 OBDepict CH 3 HN O N N H N H N Cl S O O CH 3 IC50 = 0.3 nM 479.95 CNC(=O)c1cccc(-c2cnc3[nH]cc(-c4cc(C#N)c(Cl)c(NS(C)(=O)=O)c4)c3c2)c1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4788688 OBDepict N HN S O O H 3 C N H N O H 3 C CH 3 O HO IC50 = 0.33 nM 490.54 CC(C)(Oc1ccc(-c2cnc3[nH]cc(-c4cc(C#N)cc(NS(C)(=O)=O)c4)c3c2)cc1)C(=O)O Homo sapiens CHEMBL4679411 single protein format
CHEMBL4760435 OBDepict N Cl HN S N O O H 3 C H N N N H 3 C IC50 = 0.43 nM 535.07 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5cc(C#N)c(Cl)c(NS(C)(=O)=O)c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4754003 OBDepict CH 3 N N N N H N N H IC50 = 0.44 nM 422.54 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5ccc6[nH]ncc6c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4797770 OBDepict N HN S O O H 3 C N H N H 3 C H 3 C O HO IC50 = 0.47 nM 474.54 CC(C)(C(=O)O)c1ccc(-c2cnc3[nH]cc(-c4cc(C#N)cc(NS(C)(=O)=O)c4)c3c2)cc1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4746566 OBDepict Cl H 2 N N O H 3 C H 3 C O OH IC50 < 0.6 nM 382.85 CC(C)(Oc1ccc(-c2cnc(N)c(-c3ccc(Cl)cc3)c2)cc1)C(=O)O Homo sapiens CHEMBL4681967 single protein format
CHEMBL4780310 OBDepict N Cl HN S N O O H 3 C H N N N N CH 3 IC50 = 0.68 nM 510.02 CN1CCC(n2cc(-c3cnc4[nH]cc(-c5cc(C#N)c(Cl)c(NS(C)(=O)=O)c5)c4c3)cn2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4781043 OBDepict N N H S O O CH 3 N H N N N H 3 C IC50 = 0.8 nM 468.54 Cn1cc(-c2ccc(-c3cnc4[nH]cc(-c5cc(C#N)cc(NS(C)(=O)=O)c5)c4c3)cc2)cn1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4743105 OBDepict N N H N N N CH 3 IC50 = 0.91 nM 407.52 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5cccc(C#N)c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL3684049 OBDepict NH 2 N N H O S N N H O NH 2 IC50 = 1.3 nM 500.63 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CCC(N)CC2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684025 OBDepict OH N H S N NH O NH 2 O H 3 C CH 3 IC50 = 1.6 nM 396.47 CC(C)=CC(=O)Nc1sc(Nc2ccc3cc(CO)ccc3c2)nc1C(N)=O Homo sapiens CHEMBL3705651 single protein format
CHEMBL522892 OBDepict CH 3 N N N N H NH 2 O N H F IC50 = 2.0 nM 392.44 CN1CCN(c2ccc3nc(-c4c(N)c5c(F)cccc5[nH]c4=O)[nH]c3c2)CC1 Homo sapiens CHEMBL3756567 single protein format
CHEMBL3684056 OBDepict H 2 N O N S N H N H O N H 3 C N IC50 = 2.3 nM 482.57 Cc1nccn1Cc1ccc(C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684039 OBDepict H 2 N O N S N H NH O N N N IC50 = 2.5 nM 469.53 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2cncn2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684048 OBDepict H 3 C N CH 3 H N N H O S N NH O NH 2 IC50 = 2.6 nM 514.66 CN(C)[C@H]1CCN(Cc2ccc(C(=O)Nc3sc(Nc4ccc5ccccc5c4)nc3C(N)=O)cc2)C1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684034 OBDepict OH N N N H O S N N H O NH 2 IC50 = 2.7 nM 530.65 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CCN(CCO)CC2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684051 OBDepict H N N N N N H O S N HN O NH 2 IC50 = 2.9 nM 470.52 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cc2nn[nH]n2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684045 OBDepict H 2 N O N S N H NH O N N IC50 = 3.0 nM 468.54 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684047 OBDepict O N H S N N H O H 2 N N H H 2 N IC50 = 3.0 nM 486.6 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CC[C@H](N)C2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684063 OBDepict H 2 N O N S N H NH O N N N IC50 = 3.0 nM 469.53 NC(=O)c1nc(Nc2ccc3ncccc3c2)sc1NC(=O)c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL2312144 OBDepict CH 3 O N N H N N CH 3 O CH 3 N IC50 = 3.0 nM 429.52 COc1ccc(C#N)cc1-c1ccnc(Nc2ccc(N3CCN(C)CC3)c(OC)c2)c1 Homo sapiens CHEMBL2320000 single protein format
CHEMBL3684057 OBDepict H 3 C N N N H O S N N H O H 2 N IC50 = 3.1 nM 482.57 Cc1cn(Cc2ccc(C(=O)Nc3sc(Nc4ccc5ccccc5c4)nc3C(N)=O)cc2)cn1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684038 OBDepict H 3 C N N N H O S N HN O H 2 N IC50 = 3.2 nM 514.66 CN1CCCN(Cc2ccc(C(=O)Nc3sc(Nc4ccc5ccccc5c4)nc3C(N)=O)cc2)CC1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684031 OBDepict OH N N H O S N N H O NH 2 IC50 = 3.4 nM 501.61 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CCC(O)CC2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684061 OBDepict OH N N N H O S N N H O NH 2 IC50 = 3.5 nM 498.57 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2cnc(CO)c2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684029 OBDepict OH N H N H O S N N H O H 2 N IC50 = 3.7 nM 461.55 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CNCCO)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL4778005 OBDepict CH 3 N N N N H N N H IC50 = 3.8 nM 422.54 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5ccc6[nH]cnc6c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL3684050 OBDepict HO N H O S N N H O NH 2 IC50 = 4.0 nM 380.43 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)C#CCCO Homo sapiens CHEMBL3705651 single protein format
CHEMBL2312145 OBDepict CH 3 O N N H N N CH 3 O Cl CH 3 IC50 = 4.0 nM 438.96 COc1ccc(Cl)cc1-c1ccnc(Nc2ccc(N3CCN(C)CC3)c(OC)c2)c1 Homo sapiens CHEMBL2320000 single protein format
CHEMBL3683994 OBDepict CH 3 N N NH O S N N H O H 2 N N IC50 = 4.1 nM 487.59 CN1CCN(c2ccc(C(=O)Nc3sc(Nc4ccc5ncccc5c4)nc3C(N)=O)cc2)CC1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684033 OBDepict O HN N N H O S N N H O H 2 N IC50 = 4.2 nM 500.58 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CCNC(=O)C2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684030 OBDepict CH 3 N H O S N N H O H 2 N IC50 = 4.4 nM 350.4 CC#CC(=O)Nc1sc(Nc2ccc3ccccc3c2)nc1C(N)=O Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684046 OBDepict OH N H O S N N H O NH 2 IC50 = 4.5 nM 366.4 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)C#CCO Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684066 OBDepict O N H S N N H O NH 2 N N N IC50 = 4.8 nM 469.53 NC(=O)c1nc(Nc2cccc3ncccc23)sc1NC(=O)c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684042 OBDepict O N H S N N H O H 2 N N H HO IC50 = 5.0 nM 487.59 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CC[C@H](O)C2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL2312143 OBDepict H 3 C O N N N H N N H 3 C IC50 = 5.0 nM 399.5 COc1ccc(C#N)cc1-c1ccnc(Nc2ccc(N3CCN(C)CC3)cc2)c1 Homo sapiens CHEMBL2320000 single protein format
CHEMBL3683991 OBDepict CH 3 N N N H O S N HN O H 2 N IC50 = 5.1 nM 500.63 CN1CCN(Cc2ccc(C(=O)Nc3sc(Nc4ccc5ccccc5c4)nc3C(N)=O)cc2)CC1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL2436978 OBDepict CH 3 N N N N H N H IC50 = 5.2 nM 421.55 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5ccc6[nH]ccc6c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL3684072 OBDepict OH N N N N H O S N N H O NH 2 IC50 = 5.3 nM 499.56 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2cc(CO)nn2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3683993 OBDepict H 2 N N H O S N NH O H 2 N IC50 = 5.3 nM 417.49 NCc1ccc(C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL2312140 OBDepict N N Cl N N H O N H 3 C N H 3 C IC50 = 5.4 nM 448.96 COc1cc(Nc2ncc(Cl)c(-c3cccc(CC#N)c3)n2)ccc1N1CCN(C)CC1 Homo sapiens CHEMBL2319997 cell-based format
CHEMBL3684071 OBDepict O N H S N N H O NH 2 N N N IC50 = 5.5 nM 469.53 NC(=O)c1nc(Nc2cccc3cccnc23)sc1NC(=O)c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684041 OBDepict O N H S N N H O H 2 N N H HO IC50 = 5.5 nM 487.59 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CC[C@@H](O)C2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684007 OBDepict OH N H S N N H O H 2 N O S IC50 = 5.5 nM 424.51 NC(=O)c1nc(Nc2ccc3cc(CO)ccc3c2)sc1NC(=O)c1ccsc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684040 OBDepict OH N N H O S N HN O NH 2 IC50 = 5.6 nM 473.56 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CC(O)C2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684004 OBDepict H 2 N O N S N H N CH 3 O S N N O IC50 = 5.7 nM 508.63 CN(c1ccc2ncccc2c1)c1nc(C(N)=O)c(NC(=O)c2csc(CN3CCOCC3)c2)s1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684016 OBDepict OH N H O S N N H O H 2 N IC50 = 5.8 nM 432.51 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CCO)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL4283353 OBDepict CH 3 N H H 3 C H N N N H H OH N N H 3 C IC50 = 5.8 nM 504.72 CCC[C@H](C)Nc1ncc2c(-c3ccc(CN4CCCN(C)CC4)cc3)cn([C@H]3CC[C@H](O)CC3)c2n1 Homo sapiens CHEMBL4838726 cell-based format
CHEMBL3684024 OBDepict OH N H S N N H O NH 2 O IC50 = 5.8 nM 382.45 NC(=O)c1nc(Nc2ccc3cc(CO)ccc3c2)sc1NC(=O)C1CC1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684044 OBDepict H 2 N O N S N H NH O N N N N IC50 = 5.9 nM 470.52 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2cnnn2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684058 OBDepict O N H S N N H O H 2 N N N + N O _ O IC50 = 5.9 nM 513.54 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2cnc([N+](=O)[O-])c2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684043 OBDepict CH N H O S N N H O H 2 N IC50 = 6.0 nM 336.38 C#CC(=O)Nc1sc(Nc2ccc3ccccc3c2)nc1C(N)=O Homo sapiens CHEMBL3705651 single protein format
CHEMBL2312142 OBDepict CH 3 O N N H N N CH 3 N IC50 = 6.0 nM 399.5 COc1cc(Nc2cc(-c3cccc(C#N)c3)ccn2)ccc1N1CCN(C)CC1 Homo sapiens CHEMBL2320000 single protein format
CHEMBL3639829 OBDepict CH 3 O N H N S N H O NH 2 O N N IC50 = 6.1 nM 498.57 COc1ccc2cc(Nc3nc(C(N)=O)c(NC(=O)c4ccc(Cn5ccnc5)cc4)s3)ccc2c1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684069 OBDepict CH 3 N O N N H O S N N H O H 2 N IC50 = 6.2 nM 484.54 Cc1nnc(Cc2ccc(C(=O)Nc3sc(Nc4ccc5ccccc5c4)nc3C(N)=O)cc2)o1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684037 OBDepict HO N N H O S N N H O NH 2 IC50 = 6.8 nM 515.64 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CCCCC2CO)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL4758384 OBDepict H 3 C N N N N H HN S O O H 3 C IC50 = 7.1 nM 475.62 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5cccc(NS(C)(=O)=O)c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL3684060 OBDepict H 2 N O N S N H N H O N N N H 3 C N IC50 = 7.1 nM 484.55 Cc1nnnn1Cc1ccc(C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684020 OBDepict CH 3 H 3 C N H O S N N H O NH 2 F IC50 = 7.2 nM 384.44 CC(C)=CC(=O)Nc1sc(Nc2ccc3ccc(F)cc3c2)nc1C(N)=O Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684035 OBDepict HO N N N H O S N N H O NH 2 IC50 = 7.2 nM 516.63 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(N2CCN(CCO)CC2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684000 OBDepict H 2 N O N S N H NH O N H IC50 = 7.5 nM 377.43 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc[nH]1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684064 OBDepict O N H S S N N N H O NH 2 N IC50 = 7.7 nM 474.57 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2ccnc2)s1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL4741790 OBDepict CH 3 N N N N H N N N H IC50 = 7.9 nM 423.52 CN1CCN(Cc2ccc(-c3cnc4[nH]cc(-c5cnc6[nH]ncc6c5)c4c3)cc2)CC1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL4641090 OBDepict CH 3 NH H 3 C N N H NH O N F H N HO H 3 C CH 3 N IC50 = 8.0 nM 415.47 CC(C)Nc1cc(Nc2ccn3nccc3n2)ncc1C(=O)NC[C@@H](F)C(C)(C)O Homo sapiens CHEMBL4625641 assay format
CHEMBL2312148 OBDepict N O CH 3 N N H O N CH 3 O IC50 = 8.0 nM 416.48 COc1ccc(C#N)cc1-c1ccnc(Nc2ccc(N3CCOCC3)c(OC)c2)c1 Homo sapiens CHEMBL2320000 single protein format
CHEMBL3683989 OBDepict O N H S N N H N H O H 2 N N IC50 = 8.0 nM 514.66 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(NCCN2CCCCC2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684005 OBDepict H 3 C N N S N H O S N HN O NH 2 N IC50 = 8.2 nM 507.65 CN1CCN(Cc2cc(C(=O)Nc3sc(Nc4cccc5ncccc45)nc3C(N)=O)cs2)CC1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684036 OBDepict NH 2 N H N H O S N HN O H 2 N IC50 = 8.4 nM 446.54 NCCNc1ccc(C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684073 OBDepict F NH N S N H O H 2 N O N N IC50 = 8.4 nM 486.53 NC(=O)c1nc(Nc2ccc3ccc(F)cc3c2)sc1NC(=O)c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3683987 OBDepict CH 3 N H 3 C N H N H O S N HN O H 2 N IC50 = 8.6 nM 474.59 CN(C)CCNc1ccc(C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3683992 OBDepict O N H S N N H O NH 2 N O IC50 = 8.6 nM 487.59 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(CN2CCOCC2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684070 OBDepict O N H S S N N N H O NH 2 N IC50 = 8.7 nM 474.57 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1csc(Cn2ccnc2)c1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3102859 OBDepict H N N IC50 = 9.2 nM 270.34 c1ccc(-c2cnc3[nH]cc(-c4ccccc4)c3c2)cc1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL3684002 OBDepict NH 2 O N S N H HN O S N IC50 = 9.4 nM 395.47 NC(=O)c1nc(Nc2cccc3ncccc23)sc1NC(=O)c1ccsc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684055 OBDepict O N H S N N H O NH 2 N N + N O _ O IC50 = 9.5 nM 513.54 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2ccnc2[N+](=O)[O-])cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684054 OBDepict O N H S N NH O NH 2 N N IC50 = 9.7 nM 444.52 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)C#CCCCn1ccnc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684022 OBDepict H 3 C O N H S N NH O NH 2 O H 2 N IC50 = 9.7 nM 433.49 COc1ccc2cc(Nc3nc(C(N)=O)c(NC(=O)c4ccc(N)cc4)s3)ccc2c1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684062 OBDepict F N H S N N H O H 2 N O N N IC50 = 10.1 nM 486.53 NC(=O)c1nc(Nc2ccc3cc(F)ccc3c2)sc1NC(=O)c1ccc(Cn2ccnc2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3683988 OBDepict CH 3 N N NH O S N N H O H 2 N IC50 = 10.2 nM 486.6 CN1CCN(c2ccc(C(=O)Nc3sc(Nc4ccc5ccccc5c4)nc3C(N)=O)cc2)CC1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684052 OBDepict H 2 N O N S N H NH O N N IC50 = 10.3 nM 468.54 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(Cn2cccn2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3683986 OBDepict OH N H N H O S N N H O NH 2 IC50 = 10.6 nM 447.52 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(NCCO)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3683999 OBDepict CH 3 OH N H N H O S N HN O H 2 N IC50 = 10.7 nM 461.55 CC(O)CNc1ccc(C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684053 OBDepict O N H S N NH O NH 2 N N N IC50 = 10.7 nM 445.51 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)C#CCCCn1cncn1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL2312147 OBDepict H 3 C O N N N H N O IC50 = 11.0 nM 386.46 COc1ccc(C#N)cc1-c1ccnc(Nc2ccc(N3CCOCC3)cc2)c1 Homo sapiens CHEMBL2320000 single protein format
CHEMBL2312154 OBDepict H 3 C O N N N H F N N H 3 C CH 3 IC50 = 11.0 nM 445.54 COc1ccc(C#N)cc1-c1ccnc(Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)c1 Homo sapiens CHEMBL2320000 single protein format
CHEMBL3684028 OBDepict OH HN S N N H O NH 2 O S CH 3 IC50 = 11.1 nM 438.53 Cc1ccc(C(=O)Nc2sc(Nc3ccc4cc(CO)ccc4c3)nc2C(N)=O)s1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL4795159 OBDepict CH 3 N N N N H N H O H 3 C IC50 = 12.0 nM 439.56 CC(=O)Nc1cccc(-c2c[nH]c3ncc(-c4ccc(CN5CCN(C)CC5)cc4)cc23)c1 Homo sapiens CHEMBL4679411 single protein format
CHEMBL3684003 OBDepict NH 2 O N S N H N H O S N IC50 = 12.0 nM 395.47 NC(=O)c1nc(Nc2ccc3cnccc3c2)sc1NC(=O)c1ccsc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684013 OBDepict OH N N H O S N HN O NH 2 IC50 = 12.7 nM 487.59 NC(=O)c1nc(Nc2ccc3ccccc3c2)sc1NC(=O)c1ccc(N2CCC(O)CC2)cc1 Homo sapiens CHEMBL3705651 single protein format
CHEMBL3684010 OBDepict H 3 C CH 3 N H O S N N H O H 2 N IC50 = 12.7 nM 366.45 CC(C)=CC(=O)Nc1sc(Nc2ccc3ccccc3c2)nc1C(N)=O Homo sapiens CHEMBL3705651 single protein format