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P07948 | LYN_HUMAN | Tyrosine-protein kinase Lyn (LYN)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ Domain: "SH3" // SH3_1 ]

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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
CHEMBL4867931 OBDepict H 3 C O N H S N O O H 2 N O HN IC50 = -42200.0 nM 464.55 COc1cc(NS(=O)(=O)C2CC2)ccc1-c1cnc(N)c(-c2ccc3c(c2)CCNC3=O)c1 Homo sapiens CHEMBL4804410 cell-based format
CHEMBL4855542 OBDepict NH 2 N S N O NH IC50 = -41400.0 nM 372.45 Nc1ncc(-c2cccc3ncsc23)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804410 cell-based format
CHEMBL4855730 OBDepict F NH S N O O H 2 N O HN IC50 = -21900.0 nM 452.51 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804410 cell-based format
CHEMBL4859660 OBDepict NH 2 N F + N O NH O _ O IC50 = -12400.0 nM 378.36 Nc1ncc(-c2cccc([N+](=O)[O-])c2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804410 cell-based format
CHEMBL4860979 OBDepict F S N O O CH 3 N H 2 N O N H IC50 = -10300.0 nM 466.54 CN(C1CC1)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3ccc4c(c3)CCNC4=O)c2)c(F)c1 Homo sapiens CHEMBL4804410 cell-based format
CHEMBL4868141 OBDepict H 2 N N O O HN NH S O O IC50 = -1300.0 nM 532.67 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2OC2CCCCC2)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804410 cell-based format
CHEMBL1784637 OBDepict HO N N F F F N H O CH 3 N N CH 3 N H O CH 3 IC50 < 0.15 nM 582.63 CNC(=O)c1ncc(C#Cc2cc(C(=O)Nc3ccc(CN4CCN(CCO)CC4)c(C(F)(F)F)c3)ccc2C)n1C Homo sapiens CHEMBL1785333 single protein format
CHEMBL1171837 OBDepict H 3 C N N F F F N H O CH 3 N N N IC50 = 0.24 nM 532.57 Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2cccnn12 Homo sapiens CHEMBL3998349 single protein format
CHEMBL475584 OBDepict CH 3 O N NH 2 N N N HO IC50 = 0.4 nM 443.55 COc1cccc(-c2cn(-c3ccc(CCN4CCC(O)CC4)cc3)c3ncnc(N)c23)c1 Homo sapiens CHEMBL4274924 single protein format
CHEMBL388978 OBDepict CH 3 HN H H O H O N H 3 C H 3 C N O N H IC50 = 0.49 nM 466.54 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL973448 single protein format
CHEMBL272888 OBDepict CH 3 N N N H N N HN O CH 3 N H O F F F IC50 = 0.9 nM 589.62 Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1C(=O)Nc1cnc(Nc2ccc(N3CCN(C)CC3)cc2)nc1 Homo sapiens CHEMBL951120 single protein format
CHEMBL249317 OBDepict OH HN CH 3 N N N H S O O H 2 N IC50 = 1.0 nM 371.42 Cc1ccc(O)cc1Nc1ccnc(Nc2cccc(S(N)(=O)=O)c2)n1 Homo sapiens CHEMBL923139 single protein format
CHEMBL3647967 OBDepict CH 2 HN O H H N N N N H 2 N O IC50 = 1.2 nM 454.53 C=CC(=O)N[C@H]1CC[C@@H](n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)CC1 Homo sapiens CHEMBL3887542 single protein format
CHEMBL1421 OBDepict HO N N N N N H CH 3 N S N H O H 3 C Cl IC50 = 1.2 nM 488.02 Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCO)CC2)n1 Homo sapiens CHEMBL4412237 single protein format
CHEMBL281957 OBDepict CH 3 N CH 3 N CH 3 HO N N H 3 C N H Cl Cl IC50 = 2.0 nM 484.43 CCN(CC)C/C=C/c1nc(O)c2c(ccc3nc(Nc4c(Cl)cccc4Cl)n(C)c32)c1C Homo sapiens CHEMBL769383 single protein format
CHEMBL4436086 OBDepict OH N H N N Br O O IC50 = 2.118 nM 462.3 Oc1cccc(Nc2nc(/C=C/c3cc4c(cc3Br)OCO4)nc3ccccc23)c1 Homo sapiens CHEMBL4412237 single protein format
CHEMBL2336005 OBDepict OH NH S N N O IC50 = 2.3 nM 417.53 Oc1cccc(Nc2ccnc3cc(-c4cccc(CN5CCOCC5)c4)sc23)c1 Homo sapiens CHEMBL3707752 cell membrane format
CHEMBL249097 OBDepict OH NH CH 3 N N N H O NH 2 IC50 = 3.0 nM 335.37 Cc1ccc(O)cc1Nc1ccnc(Nc2cccc(C(N)=O)c2)n1 Homo sapiens CHEMBL923139 single protein format
CHEMBL383010 OBDepict CH 3 N N Br N H O N H H 3 C N N N IC50 = 3.1 nM 572.51 Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)c(Br)c2)cc1Nc1nccc(-c2cccnc2)n1 Homo sapiens CHEMBL892515 cell-based format
CHEMBL4798527 OBDepict H 3 C N H N O N NH 2 N N H CH 3 F F F H HO IC50 = 4.0 nM 548.57 Cc1ccc(NC(=O)c2ccc(C)c(C(F)(F)F)c2)cc1C#Cc1nn([C@H]2CC[C@H](O)CC2)c2ncnc(N)c12 Homo sapiens CHEMBL4766145 single protein format
CHEMBL2347053 OBDepict H N N + N O N H O _ O IC50 = 4.0 nM 332.32 O=C1Nc2ccccc2/C1=C/c1c[nH]nc1-c1ccccc1[N+](=O)[O-] Homo sapiens CHEMBL2350678 single protein format
CHEMBL364623 OBDepict CH 3 N N H N H 3 C N S N H O H 3 C Cl IC50 = 4.0 nM 373.87 Cc1cc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)nc(C)n1 Homo sapiens CHEMBL912342 single protein format
CHEMBL256101 OBDepict Cl Cl CH 3 N N N N H O + N _ O Ki = 4.19 nM 510.43 Cc1cc(-c2c(Cl)cccc2Cl)cc2nnc(Nc3ccc(OCC[N+]4([O-])CCCC4)cc3)nc12 Homo sapiens CHEMBL934544 single protein format
CHEMBL203343 OBDepict H 3 C N N F F F N H O N H CH 3 N N N IC50 = 4.8 nM 561.61 Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1Nc1nccc(-c2cccnc2)n1 Homo sapiens CHEMBL892515 cell-based format
CHEMBL1086731 OBDepict H 2 N N N N N H N CH 3 N H O S H 3 C H 3 C CH 3 IC50 = 5.0 nM 497.63 Cc1ccc(NC(=O)c2ccc(C(C)(C)C)s2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL1080475 OBDepict H 2 N N N N HN N H 3 C N H O N H 3 C CH 3 H 3 C IC50 = 7.0 nM 492.59 Cc1ccc(NC(=O)c2ccncc2C(C)(C)C)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL1163016 OBDepict OH HN N N N N H O CH 3 CH 3 N H 3 C H 3 C . O IC50 = 7.0 nM 499.6 CC1(C)CC(NC(=O)c2cccc(-c3cc4nccc(Nc5cccc(O)c5)n4n3)c2)CC(C)(C)N1[O] Homo sapiens CHEMBL1046247 single protein format
CHEMBL4467948 OBDepict Cl Cl N H O CH 3 H 2 N N N N CH 3 IC50 = 7.0 nM 476.37 Cc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cc1C#Cc1cc(-c2cnn(C)c2)cnc1N Homo sapiens CHEMBL4839599 single protein format
CHEMBL288441 OBDepict CH 3 O O N N H N N Cl O H 3 C Cl N CH 3 IC50 = 8.0 nM 530.46 COc1cc(Nc2c(C#N)cnc3cc(OCCCN4CCN(C)CC4)c(OC)cc23)c(Cl)cc1Cl Homo sapiens CHEMBL1244336 single protein format
CHEMBL205723 OBDepict H 3 C N N F F F N H O N H CH 3 N N N N IC50 = 8.5 nM 562.6 Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1Nc1nccc(-c2cncnc2)n1 Homo sapiens CHEMBL892515 cell-based format
CHEMBL4862806 OBDepict CH 3 N N N H 2 N CH 3 NH O F F F F F F IC50 = 9.0 nM 543.47 Cc1ccc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1C#Cc1cc(-c2cnn(C)c2)cnc1N Homo sapiens CHEMBL4839599 single protein format
CHEMBL4525187 OBDepict H 2 N N N N H N O H O IC50 = 10.0 nM 441.54 Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C[C@H]1CCCN1C[C@@H]1CO1 Homo sapiens CHEMBL4347065 single protein format
CHEMBL4640019 OBDepict OH N N N H N H O O IC50 < 10.0 nM 366.42 O=C(NCC1CCOCC1)c1n[nH]c2ccc(-c3cncc(CO)c3)cc12 Homo sapiens CHEMBL4615953 single protein format
CHEMBL1076433 OBDepict CH 3 N N Cl HN O N H CH 3 N N N N H 2 N IC50 = 10.0 nM 596.14 CCN1CCN(Cc2ccc(C(=O)Nc3ccc(C)c(Nc4nc5ccccc5n4-c4cc(N)ncn4)c3)cc2Cl)CC1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL1916715 OBDepict H 3 C O NH N N O N H N N CH 3 H 3 C CH 3 IC50 = 10.9 nM 430.51 COc1cc2nc(Nc3ccccc3C)c3cncn3c2cc1NC(=O)/C=C/CN(C)C Homo sapiens CHEMBL1918489 cell-based format
CHEMBL1916888 OBDepict CH 3 N H 3 C N O CH 3 N N N N H CH 3 OH IC50 = 10.9 nM 430.51 Cc1ccc(O)cc1Nc1nc2ccc(N(C)C(=O)/C=C/CN(C)C)cc2n2cncc12 Homo sapiens CHEMBL1918489 cell-based format
CHEMBL206834 OBDepict H 3 C N CH 3 H N F F F HN O N H CH 3 N N N N IC50 = 11.0 nM 576.63 Cc1ccc(NC(=O)c2ccc(CN3CC[C@H](N(C)C)C3)c(C(F)(F)F)c2)cc1Nc1nccc(-c2cncnc2)n1 Homo sapiens CHEMBL892515 cell-based format
CHEMBL3182647 OBDepict H 2 C N O N N N N NH 2 O Ki = 14.0 nM 440.51 C=CC(=O)N1CCCC(n2nc(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc32)C1 Homo sapiens CHEMBL3707976 single protein format
CHEMBL1079945 OBDepict NH 2 N N N N H N CH 3 HN O F F F IC50 = 14.0 nM 503.49 Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL1087524 OBDepict H 2 N N N N HN N H 3 C HN O F F F IC50 = 15.0 nM 503.49 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL1087127 OBDepict H 2 N N N N HN N H 3 C HN O H 3 C CH 3 IC50 = 15.0 nM 477.57 Cc1ccc(C(=O)Nc2cccc(C(C)C)c2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL1087128 OBDepict H 2 N N N N HN N H 3 C HN O CH 3 CH 3 H 3 C IC50 = 16.0 nM 491.6 Cc1ccc(C(=O)Nc2cccc(C(C)(C)C)c2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL4644718 OBDepict H 3 C O O HN O N H N H 3 C N N CH 3 IC50 = 16.0 nM 561.69 COC(=O)c1ccc2c(c1)NC(=O)/C2=C(Nc1ccc(-n2c(C)ccc2CN2CCN(C)CC2)cc1)c1ccccc1 Homo sapiens CHEMBL4623166 single protein format
CHEMBL4447631 OBDepict HO N CH 3 N F N H N N CH 3 N N H 3 C CH 3 IC50 = 17.0 nM 467.59 Cc1cnc(Nc2ccc(N3CCC(N(C)CCO)CC3)c(F)c2)nc1-c1cnn(C(C)C)c1 Homo sapiens CHEMBL4323946 single protein format
CHEMBL1916906 OBDepict CH 3 NH F N N N N H CH 3 IC50 = 19.0 nM 321.36 CNc1cc2c(cc1F)nc(Nc1ccccc1C)c1cncn12 Homo sapiens CHEMBL1918489 cell-based format
CHEMBL4106978 OBDepict O N H H N N N H 2 N HN O N F F F IC50 = 20.0 nM 535.53 Nc1nccn2c([C@@H]3CC[C@H]4CCC(=O)N4C3)nc(-c3ccc(C(=O)Nc4cc(C(F)(F)F)ccn4)cc3)c12 Homo sapiens CHEMBL4727426 single protein format
CHEMBL436137 OBDepict CH 3 CH 3 CH 3 N N N N H O N IC50 = 21.0 nM 453.59 Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCN4CCCC4)cc3)nnc2c1 Homo sapiens CHEMBL908985 single protein format
CHEMBL410295 OBDepict CH 3 N N N H N N N O N N CH 3 H 3 C IC50 = 21.0 nM 530.64 Cc1cccc(C)c1-n1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n2c3ccccc3nc12 Homo sapiens CHEMBL934196 single protein format
CHEMBL1916713 OBDepict H 3 C O NH N N O NH N N CH 3 IC50 = 21.3 nM 468.56 COc1cc2nc(Nc3ccccc3C)c3cncn3c2cc1NC(=O)C#CCN1CCCCC1 Homo sapiens CHEMBL1918489 cell-based format
CHEMBL516913 OBDepict N N N H S CH 3 N O H H 3 C N CH 3 H 3 C IC50 = 23.0 nM 467.6 COc1ccc(CN(C)C)cc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 Homo sapiens CHEMBL990378 single protein format
CHEMBL3975634 OBDepict CH 3 O H O N H N H H 3 C N N HO IC50 = 24.32 nM 452.51 CN[C@H]1CC2OC([C@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(O)=NC4 Homo sapiens CHEMBL3707745 single protein format
CHEMBL385956 OBDepict O N H N H CH 3 N F F F N N IC50 < 25.0 nM 449.44 Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1ncccc1-c1ccncn1 Homo sapiens CHEMBL908522 single protein format
CHEMBL230686 OBDepict Cl Cl H 3 C N N N N H O N Ki = 25.9 nM 494.43 Cc1cc(-c2c(Cl)cccc2Cl)cc2nnc(Nc3ccc(OCCN4CCCC4)cc3)nc12 Homo sapiens CHEMBL905849 single protein format
CHEMBL1090360 OBDepict O N H N N S N N HN N O IC50 = 26.0 nM 587.71 O=C(Cc1ccccc1)Nc1cccc(-c2nc3sccn3c2-c2ccnc(Nc3cccc(N4CCOCC4)c3)n2)c1 Homo sapiens CHEMBL1109688 single protein format
CHEMBL272198 OBDepict CH 3 O O H 3 C O N NH O IC50 = 27.0 nM 414.46 COc1cc2nccc(Oc3ccc4c(C(=O)NC5CC5)cccc4c3)c2cc1OC Homo sapiens CHEMBL950240 single protein format
CHEMBL1092754 OBDepict OH N H O N N CH 3 O O OH IC50 = 27.7 nM 455.47 Cn1cc(/C=C2Oc3cccc(O)c3C2=O)c2c(-c3ccc(C(=O)NCCO)cc3)ccnc21 Homo sapiens CHEMBL1107905 single protein format
CHEMBL1076193 OBDepict CH 3 N N HN F F F O N H H 3 C N N N N H 2 N IC50 = 28.0 nM 583.58 Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nc5ccccc5n4-c4cc(N)ncn4)c3)cc(C(F)(F)F)c2)cn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL477817 OBDepict N N NH S CH 3 N H N O IC50 = 28.0 nM 427.53 Cc1c(Nc2c(C#N)cnc3sc(/C=C/C(=O)N4CCCC4)cc23)ccc2[nH]ccc12 Homo sapiens CHEMBL982996 single protein format
CHEMBL47203 OBDepict H 3 C N N H H N N N NH 2 O IC50 = 29.0 nM 482.63 CN1CCN([C@H]2CC[C@@H](n3cc(-c4ccc(Oc5ccccc5)cc4)c4c(N)ncnc43)CC2)CC1 Homo sapiens CHEMBL823026 single protein format
CHEMBL2170582 OBDepict CH 3 NH O O N H N N N H F N H O O F F Ki = 30.0 nM 474.4 CNC(=O)COc1cccc(Nc2ncc(F)c(Nc3ccc4c(c3)NC(=O)C(F)(F)O4)n2)c1 Homo sapiens CHEMBL2173385 single protein format
CHEMBL447107 OBDepict HO N N N N H N CH 3 N N N HN N CH 3 Cl IC50 = 30.0 nM 571.09 Cc1nc(Nc2cc(-n3c(Nc4c(C)cccc4Cl)nc4ccccc43)ncn2)cc(N2CCN(CCO)CC2)n1 Homo sapiens CHEMBL994993 cell-based format
CHEMBL3262616 OBDepict O N H N N N H NH H N H NH 2 H IC50 = 32.0 nM 389.46 N[C@H]1CCCC[C@H]1Nc1cc2nc[nH]c(=O)c2c(Nc2cccc3[nH]ccc23)n1 Homo sapiens CHEMBL3268709 single protein format
CHEMBL1097700 OBDepict CH 3 N H OH O O H HO H CH 3 H HO H CH 3 O IC50 = 35.0 nM 375.42 CNc1cc(O)c2c(c1)/C=C/C[C@H](O)[C@H](O)C(=O)/C=C[C@@H](C)[C@H](C)OC2=O Homo sapiens CHEMBL3880857 single protein format
CHEMBL205409 OBDepict CH 3 N N F N H O N H H 3 C N N N IC50 = 35.0 nM 511.61 Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)c(F)c2)cc1Nc1nccc(-c2cccnc2)n1 Homo sapiens CHEMBL892515 cell-based format
CHEMBL3808884 OBDepict CH 3 O O N H N N H CH 3 N H O N F F F N H 3 C IC50 = 37.0 nM 562.55 COC(=O)c1cc2cc(NCc3cc(NC(=O)c4cc(-n5cnc(C)c5)cc(C(F)(F)F)c4)ccc3C)cnc2[nH]1 Homo sapiens CHEMBL3811755 assay format
CHEMBL551024 OBDepict NH 2 N N H N H NH O F F F F IC50 = 40.0 nM 519.5 NCc1ccc(-c2cnc3[nH]cc(-c4cccc(NC(=O)Nc5ccc(C(F)(F)F)cc5F)c4)c3c2)cc1 Homo sapiens CHEMBL1026941 single protein format
CHEMBL1916904 OBDepict CH 3 NH N N N N H CH 3 F IC50 = 40.0 nM 321.36 CNc1ccc2nc(Nc3cc(F)ccc3C)c3cncn3c2c1 Homo sapiens CHEMBL1918489 cell-based format
CHEMBL398422 OBDepict CH 3 NH N N N H N N H O NH 2 IC50 = 40.0 nM 359.39 Cc1ccc2[nH]ncc2c1Nc1ccnc(Nc2cccc(C(N)=O)c2)n1 Homo sapiens CHEMBL923139 single protein format
CHEMBL3262357 OBDepict O N H N N NH HN N H H H H 2 N CH 3 IC50 = 44.0 nM 403.49 Cc1c[nH]c2c(Nc3nc(N[C@@H]4CCCC[C@@H]4N)cc4nc[nH]c(=O)c34)cccc12 Homo sapiens CHEMBL3268709 single protein format
CHEMBL1916883 OBDepict CH 3 N H 3 C N O CH 3 N N N N H CH 3 Cl IC50 = 44.4 nM 448.96 Cc1cccc(Cl)c1Nc1nc2ccc(N(C)C(=O)/C=C/CN(C)C)cc2n2cncc12 Homo sapiens CHEMBL1918489 cell-based format
CHEMBL1916712 OBDepict H 3 C O NH N N O NH N N CH 3 O IC50 = 46.6 nM 470.53 COc1cc2nc(Nc3ccccc3C)c3cncn3c2cc1NC(=O)C#CCN1CCOCC1 Homo sapiens CHEMBL1918489 cell-based format
CHEMBL4749037 OBDepict O O N H H N N N H 2 N HN O N F F F IC50 = 49.0 nM 537.5 Nc1nccn2c([C@@H]3CC[C@H]4COC(=O)N4C3)nc(-c3ccc(C(=O)Nc4cc(C(F)(F)F)ccn4)cc3)c12 Homo sapiens CHEMBL4727426 single protein format
CHEMBL4162913 OBDepict CH 3 O S N N O O H 3 C CH 3 H 3 C N H O CH 3 IC50 = 50.0 nM 401.49 COc1cc2ncc(C(=O)Nc3ccccc3C)n2cc1S(=O)(=O)C(C)(C)C Homo sapiens CHEMBL4135585 single protein format
CHEMBL489058 OBDepict CH 3 N N N HN N Cl S N N H 3 C IC50 = 58.0 nM 558.15 CCN1CCN(CC/C=C/c2ccc3c(Nc4ccc(Sc5nccn5C)c(Cl)c4)c(C#N)cnc3c2)CC1 Homo sapiens CHEMBL995057 single protein format
CHEMBL3616960 OBDepict CH 3 N N HN O F F F N H CH 3 O N H 3 C O IC50 = 65.9 nM 501.51 Cc1ccc(NC(=O)c2cc(N3CCN(C)CC3)cc(C(F)(F)F)c2)cc1NC(=O)c1cnoc1C Homo sapiens CHEMBL3620299 single protein format
CHEMBL4634073 OBDepict CH 3 O N H O O N NH 2 N N N H 3 C O O H 3 C H 3 C IC50 = 67.0 nM 532.6 COC(=O)Nc1ccc(-c2c(OC3CCN(C)CC3)nc3c(-c4ccc(OC)c(OC)c4)cnn3c2N)cc1 Homo sapiens CHEMBL4605810 cell-based format
CHEMBL3621496 OBDepict CH 3 N N O N H O NH 2 F IC50 = 68.0 nM 430.48 CN1CCN(C(=O)c2ccc3c(c2)[nH]c2c(C(N)=O)ccc(-c4ccccc4F)c23)CC1 Homo sapiens CHEMBL3627432 single protein format
CHEMBL3262620 OBDepict O N H N N NH HN N H H H H 2 N CH 3 O IC50 = 69.0 nM 405.46 Cc1c[nH]c2c(Nc3nc(N[C@@H]4CCOC[C@@H]4N)cc4nc[nH]c(=O)c34)cccc12 Homo sapiens CHEMBL3268709 single protein format
CHEMBL4076024 OBDepict CH 3 O N O H N N N H 2 N F N H O N F F F IC50 = 74.0 nM 571.54 COCC(=O)N1CCC[C@@H](c2nc(-c3ccc(C(=O)Nc4cc(C(F)(F)F)ccn4)cc3F)c3c(N)nccn23)C1 Homo sapiens CHEMBL4057966 single protein format
CHEMBL479470 OBDepict H 3 C O S N N CH 3 H 3 C N H N CH 3 N H IC50 = 74.0 nM 481.63 CCOc1ccc(CN(C)C)cc1-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(C#N)cnc2s1 Homo sapiens CHEMBL990378 single protein format
CHEMBL4108687 OBDepict O O N H 3 C CH 3 H H N N N H 2 N N H O N F F F IC50 = 79.0 nM 565.56 CC1(C)OC(=O)N2C[C@H](c3nc(-c4ccc(C(=O)Nc5cc(C(F)(F)F)ccn5)cc4)c4c(N)nccn34)CC[C@H]21 Homo sapiens CHEMBL4727426 single protein format
CHEMBL1080299 OBDepict H 3 C NH O N H CH 3 N N N N NH 2 IC50 = 82.0 nM 449.52 Cc1cccc(C(=O)Nc2ccc(C)c(Nc3nc4ccccc4n3-c3cc(N)ncn3)c2)c1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL3586447 OBDepict CH 3 N N N H N NH 2 O NH 2 IC50 = 82.0 nM 318.34 Cc1cc2cn[nH]c2cc1-c1cccc2c(N)c(C(N)=O)nnc12 Homo sapiens CHEMBL3588351 single protein format
CHEMBL3262618 OBDepict O N H N N N H HN N H NH 2 CH 3 H IC50 = 84.0 nM 349.4 C[C@H](N)CNc1cc2nc[nH]c(=O)c2c(Nc2cccc3cc[nH]c23)n1 Homo sapiens CHEMBL3268709 single protein format
CHEMBL4281823 OBDepict CH 3 N N N NH 2 N O O F F F IC50 = 85.0 nM 481.48 CCn1cc(-c2ccc3c(c2)CCN3C(=O)Cc2cccc(OC(F)(F)F)c2)c2c(N)ncnc21 Homo sapiens CHEMBL4261440 single protein format
CHEMBL1075628 OBDepict CH 3 N N N N H 3 C H 3 C CH 3 N H O N H H 3 C N N N N H 2 N IC50 = 88.0 nM 593.74 Cc1ccc(NC(=O)c2cc(CN3CCN(C)CC3)n(C(C)(C)C)n2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL271984 OBDepict CH 3 O O N H 3 C O O NH 2 IC50 = 88.0 nM 374.4 COc1cc2nccc(Oc3ccc4c(C(N)=O)cccc4c3)c2cc1OC Homo sapiens CHEMBL950240 single protein format
CHEMBL1086860 OBDepict NH 2 N N N N H N H 3 C N H O N H N IC50 = 96.0 nM 465.52 Cc1ccc(NC(=O)c2cc(C3CC3)n[nH]2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL3889939 OBDepict OH N H O HN N CH 3 N N H N S NH O CH 3 Cl IC50 <= 100.0 nM 518.04 Cc1nc(NCCCCCCC(=O)NO)cc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)n1 Homo sapiens CHEMBL3882097 single protein format
CHEMBL1088027 OBDepict F O F HN O N H CH 3 N N N N NH 2 IC50 = 100.0 nM 501.5 Cc1ccc(C(=O)Nc2cccc(OC(F)F)c2)cc1Nc1nc2ccccc2n1-c1cc(N)ncn1 Homo sapiens CHEMBL1113979 cell-based format
CHEMBL3965755 OBDepict OH N H O N H HN N CH 3 N N H N S NH O CH 3 Cl IC50 <= 100.0 nM 547.09 Cc1nc(NCCNCCCCCC(=O)NO)cc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)n1 Homo sapiens CHEMBL3882097 single protein format
CHEMBL3984972 OBDepict HO N H O NH N H 3 C N N H N S HN O H 3 C Cl IC50 <= 100.0 nM 504.02 Cc1nc(NCCCCCC(=O)NO)cc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)n1 Homo sapiens CHEMBL3882097 single protein format
CHEMBL3904339 OBDepict HO N H O N N N H 3 C N NH N S N H O CH 3 Cl IC50 <= 100.0 nM 587.15 Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCCCCCC(=O)NO)CC2)n1 Homo sapiens CHEMBL3882097 single protein format
CHEMBL471795 OBDepict N N N H S CH 3 N H N H 3 C CH 3 IC50 = 100.0 nM 437.57 Cc1c(Nc2c(C#N)cnc3sc(-c4ccc(CN(C)C)cc4)cc23)ccc2[nH]ccc12 Homo sapiens CHEMBL990378 single protein format
CHEMBL3901629 OBDepict OH NH O N N N CH 3 N NH N S N H O CH 3 Cl IC50 <= 100.0 nM 573.12 Cc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3Cl)s2)cc(N2CCN(CCCCCC(=O)NO)CC2)n1 Homo sapiens CHEMBL3882097 single protein format
CHEMBL571546 OBDepict O HN N O N O IC50 = 100.0 nM 431.54 O=C(Cc1ccc(-c2ccc(OCCN3CCOCC3)cc2)cn1)NCc1ccccc1 Homo sapiens CHEMBL4371243 single protein format
CHEMBL3262356 OBDepict O N H N N HN NH N H H H H 2 N IC50 = 112.0 nM 389.46 N[C@H]1CCCC[C@H]1Nc1cc2nc[nH]c(=O)c2c(Nc2cccc3cc[nH]c23)n1 Homo sapiens CHEMBL3268709 single protein format
CHEMBL4077588 OBDepict F N HN O N H 2 N N N H N F F F O IC50 = 115.0 nM 583.59 Nc1nccn2c([C@@H]3CCCN(C4CCOCC4)C3)nc(-c3ccc(C(=O)Nc4cc(C(F)(F)F)ccn4)cc3F)c12 Homo sapiens CHEMBL4057966 single protein format
CHEMBL4793380 OBDepict O NH N H N O H 3 C H 3 C CH 3 N H N O N HN IC50 = 122.0 nM 423.48 CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4c3OCCCN4)cc2)no1 Homo sapiens CHEMBL4767032 single protein format
CHEMBL1076480 OBDepict CH 3 O HN N N N N H N CH 3 HN O F F F IC50 = 126.0 nM 561.57 COCCNc1cc(-n2c(Nc3cc(NC(=O)c4cccc(C(F)(F)F)c4)ccc3C)nc3ccccc32)ncn1 Homo sapiens CHEMBL1113979 cell-based format