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P07949 | RET_HUMAN | Proto-oncogene tyrosine-protein kinase receptor Ret (RET)

3D structures mapped by conservation among orthologs

[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // Cadherin_4 ]

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[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // EUF07683 ]

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[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // Cadherin_repeat_like ]

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[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // Cadherin ]

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[ Domain: "Protein kinase" // Pkinase_Tyr ]

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[ Domain: pdbs with more than 2 multi-domains ]

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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
CHEMBL4067871 OBDepict OH N H H N OH Cl N IC50 = 0.04 nM 467.96 OC[C@H](Nc1cnc(-c2cc(Cl)ccc2O)c(-c2ccc3cnccc3c2)c1)c1ccccc1 Homo sapiens CHEMBL4018630 single protein format
CHEMBL4218013 OBDepict CH 3 O O N H F N H HN O F F F N N CH 3 IC50 = 0.1 nM 561.58 CCOc1cc(-c2ccc(NC(=O)Nc3ccc(CN4CCN(CC)CC4)c(C(F)(F)F)c3)c(F)c2)c[nH]c1=O Homo sapiens CHEMBL4199570 single protein format
CHEMBL1784637 OBDepict HO N N F F F N H O CH 3 N N CH 3 N H O CH 3 IC50 = 0.2 nM 582.63 CNC(=O)c1ncc(C#Cc2cc(C(=O)Nc3ccc(CN4CCN(CCO)CC4)c(C(F)(F)F)c3)ccc2C)n1C Homo sapiens CHEMBL1785336 single protein format
CHEMBL4218563 OBDepict CH 3 O O N H F N H O F F F NH 2 CH 3 H 3 C IC50 = 0.2 nM 505.51 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2ccc(CC(C)(C)N)c(C(F)(F)F)c2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL4062877 OBDepict OH HN H N HO F N H 3 C N H IC50 = 0.2 nM 454.51 Cc1n[nH]c2ccc(-c3cc(N[C@@H](CO)c4ccccc4)cnc3-c3cc(F)ccc3O)cc12 Homo sapiens CHEMBL4018630 single protein format
CHEMBL4872605 OBDepict CH 3 N N H N N N N CH 3 H O N H 3 C H N N N F IC50 = 0.36 nM 544.64 Cc1cc(Nc2cc(C)[nH]n2)nc(N2CCC3(CCCN([C@@H](C)c4ccc(-n5cc(F)cn5)nc4)C3=O)CC2)n1 Homo sapiens CHEMBL4836452 single protein format
CHEMBL3355009 OBDepict H 3 C O O N H F N H O N O CH 3 H 3 C F F F IC50 = 0.4 nM 467.42 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2cc(C(C)(C)C(F)(F)F)on2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL4075917 OBDepict HO NH H N OH N H 3 C N F H IC50 = 0.4 nM 454.51 Cc1n[nH]c2ccc(-c3cc(N[C@@H](CO)c4ccccc4)cnc3-c3ccc(F)cc3O)cc12 Homo sapiens CHEMBL4018630 single protein format
CHEMBL4212513 OBDepict CH 3 O O N H F N H O N O F F F N H 3 C IC50 = 0.4 nM 516.45 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2cc(-c3nnc(C)o3)cc(C(F)(F)F)c2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL4205243 OBDepict H 3 C O O N H F N H O F F F H 3 C CH 3 HO IC50 = 0.4 nM 520.52 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2ccc(CC(C)(C)CO)c(C(F)(F)F)c2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL4218127 OBDepict CH 3 O O N H F N H O F F F OH CH 3 H 3 C IC50 = 0.4 nM 506.5 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2ccc(CC(C)(C)O)c(C(F)(F)F)c2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL3355010 OBDepict H 3 C O O N H F N H O O N CH 3 H 3 C F F F IC50 = 0.4 nM 467.42 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2cc(C(C)(C)C(F)(F)F)no2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL3775169 OBDepict CH 3 O O CH 3 N N H N F OH F IC50 = 0.41 nM 333.29 COc1cc2ncnc(Nc3cc(O)c(F)cc3F)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL388978 OBDepict CH 3 HN H H O H O N H 3 C H 3 C N O N H IC50 = 0.46 nM 466.54 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL973459 single protein format
CHEMBL4203429 OBDepict H 3 C O O N H F N H O F F F H 3 C CH 3 S O O CH 3 IC50 = 0.6 nM 582.62 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2ccc(CC(C)(C)CS(C)(=O)=O)c(C(F)(F)F)c2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL4870957 OBDepict CH 3 N N H N N N N CH 3 H O N H 3 C H N N N N F IC50 = 0.68 nM 545.63 Cc1cc(Nc2cc(C)[nH]n2)nc(N2CCC3(CCCN([C@@H](C)c4cnc(-n5cc(F)cn5)cn4)C3=O)CC2)n1 Homo sapiens CHEMBL4836452 single protein format
CHEMBL4105329 OBDepict OH HN H N HO Cl N H 3 C N H IC50 = 0.7 nM 470.96 Cc1n[nH]c2ccc(-c3cc(N[C@@H](CO)c4ccccc4)cnc3-c3cc(Cl)ccc3O)cc12 Homo sapiens CHEMBL4018630 single protein format
CHEMBL4205803 OBDepict CH 3 N N F F F N H NH O N N H H 3 C IC50 = 0.7 nM 512.58 CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(-c4ccc(NC)nc4)cc3)cc2C(F)(F)F)CC1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL4214146 OBDepict H 3 C O O N H F NH O F F F H 3 C N IC50 = 0.7 nM 487.45 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2ccc(C(C)C#N)c(C(F)(F)F)c2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL4853155 OBDepict H 3 C N O N H H N N N H 2 N HO Cl IC50 = 0.73 nM 440.94 CC(=O)N1CCN([C@H]2C[C@@H](n3cc(-c4ccc(Cl)c(O)c4)c4c(N)ncnc43)C2)CC1 Homo sapiens CHEMBL4834295 single protein format
CHEMBL440727 OBDepict CH 3 O O CH 3 N N H N F OH H 3 C IC50 = 0.75 nM 329.33 COc1cc2ncnc(Nc3cc(O)c(C)cc3F)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL4582651 OBDepict CH 3 O N H O H H 3 C H N N N CH 3 N H N N N N H 3 C H F IC50 = 0.78 nM 533.61 CO[C@]1(C(=O)N[C@@H](C)c2ccc(-n3cc(F)cn3)nc2)CC[C@H](c2nc(C)cc(Nc3cc(C)[nH]n3)n2)CC1 Homo sapiens CHEMBL4836452 single protein format
CHEMBL4213626 OBDepict H 3 C O O N H F N H O F F F N H 3 C CH 3 IC50 = 0.8 nM 491.49 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2ccc(CN(C)C)c(C(F)(F)F)c2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL1688861 OBDepict O HN N O H N H O H 2 N CH 3 CH 3 F F F IC50 = 0.8 nM 538.57 CC(C)(N)c1cc(C(=O)N[C@@H]2CCc3ccc(Oc4ccnc5c4CCC(=O)N5)cc3C2)cc(C(F)(F)F)c1 Homo sapiens CHEMBL1693597 single protein format
CHEMBL4877264 OBDepict H 3 C N O N H H N N N H 2 N H 2 N Cl IC50 = 0.85 nM 439.95 CC(=O)N1CCN([C@H]2C[C@@H](n3cc(-c4ccc(Cl)c(N)c4)c4c(N)ncnc43)C2)CC1 Homo sapiens CHEMBL4834295 single protein format
CHEMBL4845703 OBDepict CH 3 N N H N N N CH 3 H O N H 3 C H N N N F IC50 = 0.9 nM 543.65 Cc1cc(Nc2cc(C)[nH]n2)nc(C2CCC3(CCCN([C@@H](C)c4ccc(-n5cc(F)cn5)nc4)C3=O)CC2)n1 Homo sapiens CHEMBL4836452 single protein format
CHEMBL3687194 OBDepict CH 3 N N NH O NH 2 N H H H HO N N N H 3 C IC50 = 0.95 nM 536.73 CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)cc2)nc1N[C@H]1CC[C@H](O)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL3687212 OBDepict CH 3 N N NH O NH 2 N H H CH 3 HO H 3 C N N N H 3 C IC50 = 1.0 nM 564.78 CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)c(C)c2)nc1N[C@H]1CC[C@](C)(O)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL495727 OBDepict O NH NH N N H N N H N O IC50 = 1.0 nM 381.44 O=C(Nc1c[nH]nc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1)NC1CC1 Homo sapiens CHEMBL1009902 single protein format
CHEMBL3687215 OBDepict CH 3 N NH N O NH 2 N H O H 3 C N N N H 3 C IC50 = 1.0 nM 536.73 CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)c(C)c2)nc1NC1CCOCC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL3806189 OBDepict CH 3 N N F F F N H O HN F N N H O IC50 = 1.0 nM 584.62 CN1CCN(Cc2ccc(NC(=O)CNc3ccc(-c4ccc(NC(=O)C5CC5)nc4)cc3F)cc2C(F)(F)F)CC1 Homo sapiens CHEMBL3806822 cell-based format
CHEMBL3687202 OBDepict CH 3 N N NH O NH 2 N H H H HO H 3 C N N N H 3 C IC50 = 1.0 nM 550.75 CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)c(C)c2)nc1N[C@H]1CC[C@H](O)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL1081312 OBDepict H 2 N N N N N N N H IC50 < 1.0 nM 319.37 Nc1ncnc2c1c(-c1cnc3[nH]ccc3c1)nn2C1CCCC1 Homo sapiens CHEMBL1243929 single protein format
CHEMBL4473213 OBDepict O NH N O H 3 C H 3 C CH 3 N N S O O CH 3 IC50 = 1.0 nM 528.63 CC(C)(C)c1cc(NC(=O)Cc2ccc(-n3cnc4cc(-c5ccc(S(C)(=O)=O)cc5)ccc43)cc2)no1 Homo sapiens CHEMBL4359450 assay format
CHEMBL3687225 OBDepict CH 3 N NH N O NH 2 N H O H 3 C N N N H 3 C IC50 = 1.1 nM 536.73 CCc1nc(C(N)=O)c(Nc2ccc(N3CCN(C4CCN(C)CC4)CC3)c(C)c2)nc1NC1CCOCC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL3687222 OBDepict CH 3 N NH N O NH 2 N H O F N N H 3 C IC50 = 1.1 nM 457.55 CCc1nc(C(N)=O)c(Nc2ccc(N3CCN(C)CC3)c(F)c2)nc1NC1CCOCC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL4441604 OBDepict HO O O OH CH 3 N N NH O NH 2 N H H H HO N N H 3 C IC50 = 1.1 nM 569.66 CCc1nc(C(N)=O)c(Nc2ccc(N3CCN(C)CC3)cc2)nc1N[C@H]1CC[C@H](O)CC1.O=C(O)/C=C/C(=O)O Homo sapiens CHEMBL4418512 assay format
CHEMBL3774904 OBDepict CH 3 O O CH 3 N N H N F OH IC50 = 1.1 nM 315.3 COc1cc2ncnc(Nc3cc(O)ccc3F)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL3687207 OBDepict CH 3 N N NH O NH 2 N H H CH 3 HO H 3 C N N N H 3 C IC50 = 1.1 nM 564.78 CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)c(C)c2)nc1N[C@H]1CC[C@@](C)(O)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL3687191 OBDepict CH 3 N N NH O NH 2 N H H H HO N N H 3 C IC50 = 1.1 nM 453.59 CCc1nc(C(N)=O)c(Nc2ccc(N3CCN(C)CC3)cc2)nc1N[C@H]1CC[C@H](O)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL4461418 OBDepict HO O O OH CH 3 N NH N O NH 2 N H O F N N H 3 C IC50 = 1.1 nM 573.63 CCc1nc(C(N)=O)c(Nc2ccc(N3CCN(C)CC3)c(F)c2)nc1NC1CCOCC1.O=C(O)/C=C/C(=O)O Homo sapiens CHEMBL4418512 assay format
CHEMBL4861957 OBDepict CH 3 N N H N N N CH 3 H O O N H 3 C H N N N F IC50 = 1.12 nM 545.62 Cc1cc(Nc2cc(C)[nH]n2)nc(C2CCC3(CC2)OCCN([C@@H](C)c2ccc(-n4cc(F)cn4)nc2)C3=O)n1 Homo sapiens CHEMBL4836452 single protein format
CHEMBL4210670 OBDepict CH 3 N N F F F N H NH O N H O IC50 = 1.2 nM 499.54 CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(-c4ccc(=O)[nH]c4)cc3)cc2C(F)(F)F)CC1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL4791998 OBDepict F N H O HN N O N NH ClH IC50 = 1.21 nM 443.91 Cl.O=C1Nc2ccc(F)cc2/C1=C1/Nc2ccccc2/C1=NOCCN1CCNCC1 Homo sapiens CHEMBL4768794 single protein format
CHEMBL4846521 OBDepict CH 3 N N H N N N N CH 3 H O O N H 3 C H N N N F IC50 = 1.29 nM 546.61 Cc1cc(Nc2cc(C)[nH]n2)nc(N2CCC3(CC2)OCCN([C@@H](C)c2ccc(-n4cc(F)cn4)nc2)C3=O)n1 Homo sapiens CHEMBL4836452 single protein format
CHEMBL4091628 OBDepict CH 3 N N F F F HN O Cl N N O IC50 = 1.3 nM 598.07 CN1CCN(Cc2ccc(NC(=O)c3ccc(Cl)c(C#Cc4cncc(N5CCOCC5)c4)c3)cc2C(F)(F)F)CC1 Homo sapiens CHEMBL4002769 single protein format
CHEMBL3687217 OBDepict CH 3 N N N CH 3 N H N N NH O H 2 N Cl H H HO IC50 = 1.3 nM 557.14 Cc1cc(Nc2nc(N[C@H]3CC[C@H](O)CC3)c(Cl)nc2C(N)=O)ccc1N1CCC(N2CCN(C)CC2)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL3687220 OBDepict CH 3 N NH N O NH 2 N H O N N N H 3 C IC50 = 1.3 nM 522.7 CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)cc2)nc1NC1CCOCC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL3687210 OBDepict CH 3 N N NH O NH 2 N H H H HO H 3 C N N H 3 C CH 3 IC50 = 1.3 nM 495.67 CCc1nc(C(N)=O)c(Nc2ccc(N3CCN(C(C)C)CC3)c(C)c2)nc1N[C@H]1CC[C@H](O)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL4859281 OBDepict CH 3 N N H N N N N CH 3 H O N CH 3 H F N N F IC50 = 1.39 nM 561.64 Cc1cc(Nc2cc(C)[nH]n2)nc(N2CCC3(CCCN([C@@H](C)c4ccc(-n5cc(F)cn5)cc4F)C3=O)CC2)n1 Homo sapiens CHEMBL4836452 single protein format
CHEMBL1289601 OBDepict CH 3 O N O H 2 N O Cl N H N H O Ki = 1.5 nM 426.86 COc1cc2nccc(Oc3ccc(NC(=O)NC4CC4)c(Cl)c3)c2cc1C(N)=O Homo sapiens CHEMBL3428795 single protein format
CHEMBL3687221 OBDepict H 3 C N N N N H N N NH O H 2 N CH 3 CH 3 O IC50 = 1.5 nM 536.73 CC(C)c1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)cc2)nc1NC1CCOCC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL4875034 OBDepict CH 3 N N H N N N N H 3 C H O N CH 3 H N N N F IC50 = 1.58 nM 530.61 Cc1cc(Nc2cc(C)[nH]n2)nc(N2CCC3(CC2)CCN([C@@H](C)c2ccc(-n4cc(F)cn4)nc2)C3=O)n1 Homo sapiens CHEMBL4836452 single protein format
CHEMBL3735648 OBDepict N N H O H 3 C CH 3 N O IC50 = 1.6 nM 467.61 CC1(C)c2cc(C3CCN(CC4CCOCC4)CC3)ccc2C(=O)c2c1[nH]c1cc(C#N)ccc21 Homo sapiens CHEMBL3830907 cell-based format
CHEMBL1688860 OBDepict CH 3 N H 3 C N H O F F F H O N NH O IC50 = 1.6 nM 538.57 CN(C)Cc1cc(C(=O)N[C@@H]2CCc3ccc(Oc4ccnc5c4CCC(=O)N5)cc3C2)cc(C(F)(F)F)c1 Homo sapiens CHEMBL1693597 single protein format
CHEMBL4206308 OBDepict CH 3 O O N H F HN O F F F IC50 = 1.7 nM 434.39 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2cccc(C(F)(F)F)c2)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL3687195 OBDepict CH 3 N N N H N N HN O NH 2 H CH 3 H 3 C H OH IC50 = 1.7 nM 467.62 CC(C)c1nc(C(N)=O)c(Nc2ccc(N3CCN(C)CC3)cc2)nc1N[C@H]1CC[C@H](O)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL3775557 OBDepict CH 3 O O N H 3 C N N H F F HO IC50 = 1.7 nM 333.29 COc1cc2ncnc(Nc3c(F)ccc(O)c3F)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL4454732 OBDepict H 3 C N N N H N N NH O H 2 N H CH 3 CH 3 H HO HO O O HO IC50 = 1.7 nM 583.69 CC(C)c1nc(C(N)=O)c(Nc2ccc(N3CCN(C)CC3)cc2)nc1N[C@H]1CC[C@H](O)CC1.O=C(O)/C=C/C(=O)O Homo sapiens CHEMBL4418512 assay format
CHEMBL3775336 OBDepict CH 3 O O CH 3 N N H N F HO F IC50 = 2.0 nM 333.29 COc1cc2ncnc(Nc3ccc(F)c(O)c3F)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL3746678 OBDepict CH 3 O N N CH 3 H 3 C N H N H 3 C CH 3 N IC50 = 2.0 nM 465.6 CCc1cc2c(cc1-c1cnn(CCCN(C)C)c1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O Homo sapiens CHEMBL3748850 single protein format
CHEMBL1980995 OBDepict H 3 C NH O O N CH 3 CH 3 N O N H IC50 = 2.195 nM 466.54 CNC1CC2OC(C)(C1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL3707688 single protein format
CHEMBL3916184 OBDepict CH 3 N N F F F HN O Cl N IC50 = 2.5 nM 512.96 CN1CCN(Cc2ccc(NC(=O)c3ccc(Cl)c(C#Cc4cccnc4)c3)cc2C(F)(F)F)CC1 Homo sapiens CHEMBL3868194 single protein format
CHEMBL3774489 OBDepict CH 3 O O CH 3 N N H N Cl OH IC50 = 2.6 nM 331.76 COc1cc2ncnc(Nc3cc(O)ccc3Cl)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL3775934 OBDepict CH 3 O O N H 3 C N N H OH F IC50 = 2.6 nM 315.3 COc1cc2ncnc(Nc3cc(O)cc(F)c3)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL4209229 OBDepict CH 3 O O N H F N H O F F F F N CH 3 CH 3 IC50 = 2.8 nM 509.48 CCOc1cc(=O)[nH]cc1-c1ccc(CC(=O)Nc2cc(C(F)(F)F)cc(CN(C)C)c2F)c(F)c1 Homo sapiens CHEMBL4199570 single protein format
CHEMBL3687224 OBDepict H 3 C N N N H N N NH O H 2 N CH 3 CH 3 O IC50 = 2.9 nM 453.59 CC(C)c1nc(C(N)=O)c(Nc2ccc(N3CCN(C)CC3)cc2)nc1NC1CCOCC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL4846921 OBDepict H 3 C N N NH N N S N H S O O CH 3 IC50 = 2.9 nM 508.67 CCN1CCN(c2ccc(Nc3ncc4scc(-c5cccc(NS(C)(=O)=O)c5)c4n3)cc2)CC1 Homo sapiens CHEMBL4839029 single protein format
CHEMBL4591953 OBDepict CH 3 N N N H N N HN O NH 2 CH 3 H 3 C O HO O O HO IC50 = 2.9 nM 569.66 CC(C)c1nc(C(N)=O)c(Nc2ccc(N3CCN(C)CC3)cc2)nc1NC1CCOCC1.O=C(O)/C=C/C(=O)O Homo sapiens CHEMBL4418512 assay format
CHEMBL3809489 OBDepict NH 2 N N N N H N N H N IC50 = 3.0 nM 506.66 Nc1nc(Nc2ccc3c(c2)CC[C@@H](N2CCCC2)CC3)nn1-c1cc2c(nn1)-c1ccccc1CCC2 Homo sapiens CHEMBL4188980 assay format
CHEMBL3735401 OBDepict CH 3 O N N CH 3 H 3 C N H N O H 3 C H 3 C N IC50 = 3.0 nM 465.56 CCc1cc2c(cc1-c1cnn(CC(=O)N(C)C)c1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O Homo sapiens CHEMBL3748850 single protein format
CHEMBL237347 OBDepict HO N H CH 3 N S O O CH 3 IC50 = 3.0 nM 328.39 Cc1ccc(O)cc1Nc1ccnc2ccc(S(C)(=O)=O)cc12 Homo sapiens CHEMBL899077 cell-based format
CHEMBL3775879 OBDepict CH 3 O O CH 3 N N H N HO F IC50 = 3.2 nM 315.3 COc1cc2ncnc(Nc3ccc(F)c(O)c3)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL3301622 OBDepict CH 3 O N N H N N N HN O H 2 N CH 3 N H 3 C O IC50 = 3.4 nM 552.72 CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(N4CCN(C)CC4)CC3)c(OC)c2)nc1NC1CCOCC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL3671311 OBDepict CH 3 N CH 3 N O N N H NH O N H H 3 C H F F F F IC50 = 3.527 nM 542.54 C[C@@H](Cc1c(F)c(F)cc(F)c1F)Nc1cc[nH]c(=O)c1-c1nc2cc3c(cc2[nH]1)CN(CCN(C)C)C3=O Homo sapiens CHEMBL3707688 single protein format
CHEMBL3687223 OBDepict CH 3 O N N H N N N H 3 C NH O NH 2 CH 3 CH 3 O IC50 = 3.6 nM 483.62 COc1cc(Nc2nc(NC3CCOCC3)c(C(C)C)nc2C(N)=O)ccc1N1CCN(C)CC1 Homo sapiens CHEMBL3706336 single protein format
CHEMBL4438727 OBDepict HO O O HO CH 3 O N N H N N N H 3 C NH O NH 2 CH 3 CH 3 O IC50 = 3.6 nM 599.69 COc1cc(Nc2nc(NC3CCOCC3)c(C(C)C)nc2C(N)=O)ccc1N1CCN(C)CC1.O=C(O)/C=C/C(=O)O Homo sapiens CHEMBL4418512 assay format
CHEMBL3774580 OBDepict CH 3 O O CH 3 N N H N OH HO IC50 = 3.9 nM 313.31 COc1cc2ncnc(Nc3cccc(O)c3O)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL3774953 OBDepict CH 3 O O CH 3 N N H N F Cl HO IC50 = 3.9 nM 349.75 COc1cc2ncnc(Nc3c(F)ccc(O)c3Cl)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL2403366 OBDepict H 2 N N O N H O HN O CH 3 IC50 = 4.0 nM 366.42 COc1ccc2c(c1)/C(=C/c1cc3c([nH]1)CCN(C(=O)CCN)C3)C(=O)N2 Homo sapiens CHEMBL2406180 single protein 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 CHEMBL4766159 single protein format
CHEMBL169390 OBDepict HO N H 2 N N N IC50 = 4.0 nM 294.36 Nc1ncnc2c1c(-c1cccc(O)c1)cn2C1CCCC1 Homo sapiens CHEMBL4834261 cell-based format
CHEMBL3753341 OBDepict NH 2 N N N N N O H 3 C CH 3 IC50 = 4.0 nM 284.32 CC(C)n1nc(-c2cc(C3CC3)on2)c2c(N)ncnc21 Homo sapiens CHEMBL3756068 single protein format
CHEMBL2403377 OBDepict N N H O N H N O CH 3 IC50 = 4.0 nM 332.36 CC(=O)N1CCc2[nH]c(/C=C3C(=O)Nc4ccc(C#N)cc43)cc2C1 Homo sapiens CHEMBL2406180 single protein format
CHEMBL127907 OBDepict CH 3 O O CH 3 N N H N HO IC50 = 4.5 nM 297.31 COc1cc2ncnc(Nc3cccc(O)c3)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL478442 OBDepict CH 3 O O CH 3 N N H N HO H 3 C IC50 = 4.6 nM 311.34 COc1cc2ncnc(Nc3ccc(C)c(O)c3)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL3775511 OBDepict CH 3 O O CH 3 N N H N Cl F HO IC50 = 4.8 nM 349.75 COc1cc2ncnc(Nc3c(Cl)ccc(O)c3F)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL1738797 OBDepict CH 3 N O CH 3 H 3 C N N H O N IC50 = 4.8 nM 482.63 CCc1cc2c(cc1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O Homo sapiens CHEMBL3831011 single protein format
CHEMBL2010872 OBDepict CH 3 H 3 C N N H N H N N O N N CH 3 IC50 = 5.0 nM 477.57 CC(C)Cn1c2ccc(Nc3ncccn3)cc2c2c3c(c4c(c21)CCc1nn(C)cc1-4)C(=O)NC3 Homo sapiens CHEMBL2016117 single protein format
CHEMBL2403373 OBDepict CH 3 N HN NH O N H N N O O IC50 = 5.0 nM 490.61 CN1CCC(Nc2ccc3c(c2)/C(=C/c2cc4c([nH]2)CCN(C(=O)N2CCOCC2)C4)C(=O)N3)CC1 Homo sapiens CHEMBL2406180 single protein format
CHEMBL3797261 OBDepict H 3 C O O N N H N N F CH 3 OH N H IC50 = 5.0 nM 441.51 COc1cc2c(Nc3c(F)ccc(O)c3C)ncnc2cc1OCCCN1CCNCC1 Homo sapiens CHEMBL3804157 assay format
CHEMBL4848347 OBDepict OH N NH 2 N N H H N N O CH 3 IC50 = 5.0 nM 406.49 CC(=O)N1CCN([C@H]2C[C@@H](n3cc(-c4cccc(O)c4)c4c(N)ncnc43)C2)CC1 Homo sapiens CHEMBL4834295 single protein format
CHEMBL2180602 OBDepict CH 3 N H 3 C NH O CH 3 N H O HN F IC50 = 5.0 nM 424.52 CCN(CC)CCNC(=O)c1c(C)[nH]c2c1CCC/C2=C1/C(=O)Nc2ccc(F)cc21 Homo sapiens CHEMBL2185926 single protein format
CHEMBL475251 OBDepict CH 3 O O NH H 3 C O H 3 C N N N H F N N H O O H 3 C H 3 C IC50 = 5.0 nM 470.46 COc1cc(Nc2ncc(F)c(Nc3ccc4c(n3)NC(=O)C(C)(C)O4)n2)cc(OC)c1OC Homo sapiens CHEMBL2173012 single protein format
CHEMBL3775190 OBDepict CH 3 O O CH 3 N N H N Cl OH Cl IC50 = 5.0 nM 366.2 COc1cc2ncnc(Nc3cc(O)c(Cl)cc3Cl)c2cc1OC Homo sapiens CHEMBL3778237 assay format
CHEMBL4466555 OBDepict O N H N N CH 3 N N H HN O Cl F F F IC50 = 5.2 nM 514.9 Cc1ccc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1NC(=O)C1(c2ncnc3[nH]cnc23)CC1 Homo sapiens CHEMBL4331427 single protein format
CHEMBL3671309 OBDepict H 3 C N N O N N H HN O N H CH 3 H F F F F IC50 = 5.977 nM 568.58 C[C@@H](Cc1c(F)c(F)cc(F)c1F)Nc1cc[nH]c(=O)c1-c1nc2cc3c(cc2[nH]1)CN(C1CCN(C)CC1)C3=O Homo sapiens CHEMBL3707688 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 = 6.0 nM 532.6 COC(=O)Nc1ccc(-c2c(OC3CCN(C)CC3)nc3c(-c4ccc(OC)c(OC)c4)cnn3c2N)cc1 Homo sapiens CHEMBL4605791 cell-based format
CHEMBL4218175 OBDepict CH 3 N H N N N N N N H 3 C IC50 = 6.0 nM 405.55 CNc1ncc2c(-c3ccc(N4CCN(C)CC4)cc3)nn(CC3CCCC3)c2n1 Homo sapiens CHEMBL4188980 assay format
CHEMBL2403369 OBDepict H 3 C O NH O N H N N O N CH 3 IC50 = 6.0 nM 421.5 COc1ccc2c(c1)/C(=C/c1cc3c([nH]1)CCN(C(=O)N1CCN(C)CC1)C3)C(=O)N2 Homo sapiens CHEMBL2406180 single protein format