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Q04771 | ACVR1_HUMAN | Activin receptor type-1 (ACVR1)

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

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4790396 OBDepict CH 3 N N N N S N N IC50 = 1.0 nM 426.55 CN1CCN(c2ccc(-c3ccn4c(-c5csc6nccnc56)cnc4c3)cc2)CC1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL3818173 OBDepict O N H N NH Cl O N O IC50 = 1.2 nM 332.75 O=C(Nc1cc(Nc2c(Cl)cnc3c2OCO3)ccn1)C1CC1 Homo sapiens CHEMBL3820164 single protein format
CHEMBL4575655 OBDepict CH 3 O O NH 2 F N CH 3 N N H 3 C IC50 = 3.0 nM 434.52 COc1cc(-c2cncc(-c3ccc(N4CCN(C)CC4)cc3)c2C)cc(F)c1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL4638273 OBDepict N N O O N CH 3 O CH 3 CH 3 HN IC50 = 3.0 nM 430.51 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C#N)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4526828 OBDepict CH 3 O O NH 2 O H 3 C N CH 3 N H H 3 C N H H 3 C H 3 C IC50 = 3.0 nM 474.61 COc1cc(-c2cncc(-c3ccc(N4C[C@H](C)N(C)[C@H](C)C4)cc3)c2C)cc(OC)c1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL136106 OBDepict CH 3 N H 3 C O N H N N N H 3 C O IC50 = 4.0 nM 457.58 CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4ccccc4)c(=O)n(CC)c3n2)cc1 Homo sapiens CHEMBL4815728 single protein format
CHEMBL4641207 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N N N O CH 3 H 3 C IC50 = 4.0 nM 490.6 COc1cc(-c2cncc(-c3ccc(N4CCN(C(=O)N(C)C)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4779300 OBDepict CH 3 N N N NH O IC50 < 5.0 nM 420.52 Cc1cc(-c2cnc3cc(-c4ccc(C5COCCN5)cc4)ccn23)c2ccccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4790557 OBDepict F N N H 3 C N N H N H IC50 < 5.0 nM 437.52 Cc1cc(-c2cnc3cc(-c4ccc(C5CNCCN5)cc4)ccn23)c2cc(F)ccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4468389 OBDepict CH 3 O O NH 2 O CH 3 N CH 3 N N CH 3 CH 3 IC50 = 5.0 nM 474.61 COc1cc(-c2cncc(-c3ccc(N4CCN(C(C)C)CC4)cc3)c2C)cc(OC)c1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL2385596 OBDepict CH 3 N N N N N N IC50 < 5.0 nM 420.52 CN1CCN(c2ccc(-c3cnc4c(-c5ccnc6ccccc56)cnn4c3)cc2)CC1 Homo sapiens CHEMBL2390524 single protein format
CHEMBL4776631 OBDepict H 3 C O N H S O O NH 2 N N N H IC50 = 5.0 nM 515.64 COc1cc(NS(=O)(=O)c2ccccc2)cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2N)c1 Homo sapiens CHEMBL4771084 single protein format
CHEMBL2385582 OBDepict O N N N N N IC50 < 5.0 nM 407.48 c1ccc2c(-c3cnn4cc(-c5ccc(N6CCOCC6)cc5)cnc34)ccnc2c1 Homo sapiens CHEMBL2390524 single protein format
CHEMBL4778971 OBDepict F F N N H 3 C N N H N H IC50 < 5.0 nM 455.51 Cc1cc(-c2cnc3cc(-c4ccc(C5CNCCN5)cc4)ccn23)c2cc(F)cc(F)c2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4548795 OBDepict CH 3 O O NH 2 F N CH 3 N N CH 3 H 3 C IC50 = 5.0 nM 462.57 COc1cc(-c2cncc(-c3ccc(N4CCN(C(C)C)CC4)cc3)c2C)cc(F)c1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL4565968 OBDepict CH 3 O O NH 2 O H 3 C N CH 3 N HN IC50 = 5.0 nM 432.52 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C)cc(OC)c1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL4641530 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 HN IC50 = 5.0 nM 416.52 COc1cc(-c2cncc(-c3ccc(C4=CCNCC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4746124 OBDepict F N N H 3 C N N H O IC50 < 5.0 nM 438.51 Cc1cc(-c2cnc3cc(-c4ccc(C5COCCN5)cc4)ccn23)c2cc(F)ccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4784430 OBDepict CH 3 O N H S O O CH 3 NH 2 N N HN IC50 = 5.0 nM 453.57 COc1cc(NS(C)(=O)=O)cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2N)c1 Homo sapiens CHEMBL4771084 single protein format
CHEMBL4742906 OBDepict CH 3 N N N NH HN IC50 < 5.0 nM 419.53 Cc1cc(-c2cnc3cc(-c4ccc(C5CNCCN5)cc4)ccn23)c2ccccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4753476 OBDepict F F N N H 3 C N N H O IC50 = 5.6 nM 456.5 Cc1cc(-c2cnc3cc(-c4ccc(C5COCCN5)cc4)ccn23)c2cc(F)cc(F)c2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4648102 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 O HN IC50 = 6.0 nM 434.54 COc1cc(-c2cncc(-c3ccc(OC4CCNCC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4647724 OBDepict CH 3 O O CH 3 O CH 3 N CH 3 O N CH 3 IC50 = 6.0 nM 448.56 COc1cc(-c2cncc(-c3ccc(OC4CCN(C)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL3341943 OBDepict H 3 C O O O H 3 C CH 3 NH 2 N N H S O O CH 3 IC50 = 6.0 nM 429.5 COc1cc(-c2cc(-c3cccc(NS(C)(=O)=O)c3)cnc2N)cc(OC)c1OC Homo sapiens CHEMBL3365510 single protein format
CHEMBL4741939 OBDepict CH 3 N N N N N N CH 3 H 3 C IC50 = 6.3 nM 462.6 Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C(C)C)CC5)nc4)ccn23)c2ccccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL3586447 OBDepict CH 3 N N N H N NH 2 O NH 2 IC50 = 7.0 nM 318.34 Cc1cc2cn[nH]c2cc1-c1cccc2c(N)c(C(N)=O)nnc12 Homo sapiens CHEMBL3588248 single protein format
CHEMBL4633241 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N H 3 C IC50 = 7.0 nM 432.56 COc1cc(-c2cncc(-c3ccc(C4CCN(C)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4644571 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N N CH 3 H 3 C IC50 = 7.0 nM 461.61 COc1cc(-c2cncc(-c3ccc(N4CCN(C(C)C)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL1078178 OBDepict N N H O N N N H N O IC50 = 8.0 nM 414.47 N#CCNC(=O)c1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1 Homo sapiens CHEMBL3889143 single protein format
CHEMBL4740381 OBDepict CH 3 N N N N HN IC50 = 8.0 nM 419.53 Cc1cc(-c2cnc3cc(-c4ccc(N5CCNCC5)cc4)ccn23)c2ccccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4634857 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N H H 3 C HN H H 3 C IC50 = 8.0 nM 447.58 COc1cc(-c2cncc(-c3ccc(N4C[C@H](C)N[C@H](C)C4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4858463 OBDepict CH 3 N H 3 C O N H N N N O Cl Cl IC50 = 8.0 nM 588.54 CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(Cc4ccccc4)c3n2)cc1 Homo sapiens CHEMBL4815728 single protein format
CHEMBL4800115 OBDepict H 3 C S N H O O O H 3 C NH 2 N N N H IC50 = 9.0 nM 481.62 CCCS(=O)(=O)Nc1cc(OC)cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2N)c1 Homo sapiens CHEMBL4771084 single protein format
CHEMBL4280599 OBDepict H CH 3 N NH H H 3 C N N N N IC50 = 9.0 nM 434.55 C[C@H]1CNC[C@@H](C)N1c1ccc(-c2cnc3c(-c4ccnc5ccccc45)cnn3c2)cc1 Homo sapiens CHEMBL4263977 single protein format
CHEMBL4635321 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 HN IC50 = 9.0 nM 418.54 COc1cc(-c2cncc(-c3ccc(C4CCNCC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4847211 OBDepict CH 3 N H 3 C O N H N N N O CH 3 H 3 C Cl Cl IC50 = 9.0 nM 554.52 CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(CC(C)C)c3n2)cc1 Homo sapiens CHEMBL4815728 single protein format
CHEMBL4283638 OBDepict H 3 C N N N N S O O NH 2 IC50 = 9.0 nM 497.62 CC(c1ccc(-c2cnc3c(-c4ccc(S(N)(=O)=O)c5ccccc45)cnn3c2)cc1)N1CCCC1 Homo sapiens CHEMBL4263977 single protein format
CHEMBL4434694 OBDepict CH 3 O O NH 2 Cl N CH 3 N HN IC50 = 9.0 nM 436.94 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C)cc(Cl)c1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL4643265 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N N H 3 C IC50 = 9.0 nM 433.55 COc1cc(-c2cncc(-c3ccc(N4CCN(C)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL3341794 OBDepict H 3 C O O CH 3 O CH 3 N N N N HN IC50 = 10.0 nM 445.52 COc1cc(-c2cnn3cc(-c4ccc(N5CCNCC5)cc4)cnc23)cc(OC)c1OC Homo sapiens CHEMBL3365510 single protein format
CHEMBL3341945 OBDepict H 3 C O O CH 3 O CH 3 NH 2 N N HN IC50 = 10.0 nM 420.51 COc1cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2N)cc(OC)c1OC Homo sapiens CHEMBL3365510 single protein format
CHEMBL4434717 OBDepict CH 3 O O NH 2 F N CH 3 N H H 3 C N H H 3 C H 3 C IC50 = 10.0 nM 462.57 COc1cc(-c2cncc(-c3ccc(N4C[C@H](C)N(C)[C@H](C)C4)cc3)c2C)cc(F)c1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL4241942 OBDepict CH 3 N H O H 3 C N IC50 = 10.0 nM 300.36 Cc1cc2ccc(-c3ccnc4ccccc34)c(C)c2c(=O)[nH]1 Homo sapiens CHEMBL4235462 assay format
CHEMBL4788637 OBDepict CH 3 N N N N S N IC50 = 10.4 nM 425.56 CN1CCN(c2ccc(-c3ccn4c(-c5cccc6ncsc56)cnc4c3)cc2)CC1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4788859 OBDepict F N N H 3 C N N HN IC50 = 10.9 nM 437.52 Cc1cc(-c2cnc3cc(-c4ccc(N5CCNCC5)cc4)ccn23)c2cc(F)ccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4646278 OBDepict N N O O N CH 3 F CH 3 HN IC50 = 11.0 nM 418.47 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C#N)cc(OC)c1F Homo sapiens CHEMBL4626169 single protein format
CHEMBL4781705 OBDepict CH 3 O N H S O O CH 3 H 3 C NH 2 N N HN IC50 = 11.0 nM 481.62 COc1cc(NS(=O)(=O)C(C)C)cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2N)c1 Homo sapiens CHEMBL4771084 single protein format
CHEMBL4639700 OBDepict CH 3 O O O CH 3 H 3 C N CH 3 N N H IC50 = 13.0 nM 433.55 COc1cc(-c2cncc(-c3ccc(N4CCCNCC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4517408 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N HN IC50 = 13.0 nM 419.53 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4406751 single protein format
CHEMBL4754026 OBDepict CH 3 N N N N S N IC50 = 14.0 nM 425.56 CN1CCN(c2ccc(-c3ccn4c(-c5ccnc6ccsc56)cnc4c3)cc2)CC1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4646444 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N H 3 C IC50 = 14.0 nM 430.55 COc1cc(-c2cncc(-c3ccc(C4=CCN(C)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL3341947 OBDepict CH 3 O O H 3 C NH 2 N N HN IC50 = 14.0 nM 390.49 COc1cc(OC)cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2N)c1 Homo sapiens CHEMBL3365510 single protein format
CHEMBL4757577 OBDepict F N N H 3 C N N N HN H H 3 C IC50 = 14.7 nM 452.54 Cc1cc(-c2cnc3cc(-c4ccc(N5CCN[C@H](C)C5)nc4)ccn23)c2cc(F)ccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL3341787 OBDepict CH 3 O O CH 3 O H 3 C N N HN IC50 = 15.0 nM 405.5 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2)cc(OC)c1OC Homo sapiens CHEMBL3365510 single protein format
CHEMBL4633121 OBDepict CH 3 O O CH 3 O H 3 C N F N HN IC50 = 15.0 nM 423.49 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2F)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4795028 OBDepict CH 3 N N N N N F IC50 = 15.0 nM 437.52 CN1CCN(c2ccc(-c3ccn4c(-c5ccnc6ccc(F)cc56)cnc4c3)cc2)CC1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4797386 OBDepict H 3 C N N N N N N IC50 = 15.6 nM 460.59 Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C6CC6)CC5)nc4)ccn23)c2ccccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4278763 OBDepict NH 2 N N N S O O NH 2 IC50 = 16.0 nM 469.57 NC1(c2ccc(-c3cnc4c(-c5ccc(S(N)(=O)=O)c6ccccc56)cnn4c3)cc2)CCC1 Homo sapiens CHEMBL4263977 single protein format
CHEMBL4648735 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N S O O IC50 = 16.0 nM 468.58 COc1cc(-c2cncc(-c3ccc(N4CCS(=O)(=O)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4642165 OBDepict CH 3 O O CH 3 O H 3 C N Cl N HN IC50 = 16.0 nM 439.94 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2Cl)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4553210 OBDepict CH 3 O O NH 2 N CH 3 N HN IC50 = 17.0 nM 402.5 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C)ccc1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL3341944 OBDepict H 3 C O O CH 3 O CH 3 NH 2 N N HN IC50 = 17.0 nM 420.51 COc1cc(-c2cc(-c3cccc(N4CCNCC4)c3)cnc2N)cc(OC)c1OC Homo sapiens CHEMBL3365510 single protein format
CHEMBL4647991 OBDepict F N N N CH 3 O O CH 3 O CH 3 CH 3 IC50 = 17.0 nM 465.57 COc1cc(-c2cncc(-c3ccc(N4CCN(CCF)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4759531 OBDepict H 3 C N N N N H 3 C N F IC50 = 17.3 nM 451.55 Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2cc(F)ccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4792932 OBDepict H 3 C N N N N H 3 C N F F IC50 = 17.8 nM 469.54 Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2cc(F)cc(F)c2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4871544 OBDepict OH N N O N N H O N CH 3 CH 3 IC50 = 18.0 nM 473.58 CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4ccccc4)c(=O)n(CCO)c3n2)cc1 Homo sapiens CHEMBL4815728 single protein format
CHEMBL4859716 OBDepict CH 3 O N N O N N H Cl Cl O N CH 3 CH 3 IC50 = 18.0 nM 556.49 CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(CCOC)c3n2)cc1 Homo sapiens CHEMBL4815728 single protein format
CHEMBL4748071 OBDepict CH 3 O N N N H N N N N O N IC50 = 18.2 nM 512.62 COCCN1CCN(c2ccc(Nc3nccc(-c4c(-c5cccnc5)nn5c4COCC5)n3)cc2)CC1 Homo sapiens CHEMBL4714250 single protein format
CHEMBL4288921 OBDepict H H 3 C N NH H H 3 C N N N S O O NH 2 IC50 = 19.0 nM 512.64 C[C@H]1CNC[C@@H](C)N1c1ccc(-c2cnc3c(-c4ccc(S(N)(=O)=O)c5ccccc45)cnn3c2)cc1 Homo sapiens CHEMBL4263977 single protein format
CHEMBL4636120 OBDepict CH 3 O F O H 3 C N CH 3 N HN IC50 = 19.0 nM 407.49 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C)cc(OC)c1F Homo sapiens CHEMBL4626169 single protein format
CHEMBL4435320 OBDepict CH 3 O O NH 2 O H 3 C N CH 3 N N H 3 C IC50 = 19.0 nM 446.55 COc1cc(-c2cncc(-c3ccc(N4CCN(C)CC4)cc3)c2C)cc(OC)c1C(N)=O Homo sapiens CHEMBL4406758 cell-based format
CHEMBL4638893 OBDepict CH 3 O O CH 3 O CH 3 N CH 3 N N CH 3 IC50 = 20.0 nM 447.58 COc1cc(-c2cncc(-c3ccc(CN4CCN(C)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL49120 OBDepict CH 3 N H 3 C O N H N N N CH 3 O Cl Cl IC50 = 21.0 nM 512.44 CCN(CC)CCOc1ccc(Nc2ncc3cc(-c4c(Cl)cccc4Cl)c(=O)n(C)c3n2)cc1 Homo sapiens CHEMBL4815728 single protein format
CHEMBL4744674 OBDepict HN N N H N N N N O N IC50 = 21.7 nM 454.54 c1cncc(-c2nn3c(c2-c2ccnc(Nc4ccc(N5CCNCC5)cc4)n2)COCC3)c1 Homo sapiens CHEMBL4714250 single protein format
CHEMBL4648707 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N N O H 3 C IC50 = 22.0 nM 461.56 COc1cc(-c2cncc(-c3ccc(N4CCN(C(C)=O)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL3341946 OBDepict CH 3 O O CH 3 NH 2 N N HN IC50 = 23.0 nM 390.49 COc1ccc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2N)cc1OC Homo sapiens CHEMBL3365510 single protein format
CHEMBL3341789 OBDepict H 3 C O O CH 3 O CH 3 CH 3 N N HN IC50 = 24.0 nM 419.53 COc1cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2C)cc(OC)c1OC Homo sapiens CHEMBL3365510 single protein format
CHEMBL4783586 OBDepict CH 3 N N N N N IC50 = 24.0 nM 419.53 CN1CCN(c2ccc(-c3ccn4c(-c5ccnc6ccccc56)cnc4c3)cc2)CC1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4440168 OBDepict CH 3 O O NH 2 F N CH 3 N HN IC50 = 24.0 nM 420.49 COc1cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C)cc(F)c1C(N)=O Homo sapiens CHEMBL4406751 single protein format
CHEMBL4776838 OBDepict CH 3 N N N H N N N N O N IC50 = 24.7 nM 468.57 CN1CCN(c2ccc(Nc3nccc(-c4c(-c5cccnc5)nn5c4COCC5)n3)cc2)CC1 Homo sapiens CHEMBL4714250 single protein format
CHEMBL4749744 OBDepict CH 3 O N N N H N N N N N IC50 = 24.9 nM 510.65 COCCN1CCN(c2ccc(Nc3nccc(-c4c(-c5cccnc5)nn5c4CCCC5)n3)cc2)CC1 Homo sapiens CHEMBL4714250 single protein format
CHEMBL4293917 OBDepict H 3 C NH 2 N N N S O O NH 2 IC50 = 25.0 nM 443.53 CC(N)c1ccc(-c2cnc3c(-c4ccc(S(N)(=O)=O)c5ccccc45)cnn3c2)cc1 Homo sapiens CHEMBL4263977 single protein format
CHEMBL2385591 OBDepict HN N N N N N IC50 = 26.2 nM 406.49 c1cc(-c2cnn3cc(-c4ccc(N5CCNCC5)cc4)cnc23)c2cccnc2c1 Homo sapiens CHEMBL2390524 single protein format
CHEMBL3668019 OBDepict CH 3 N CH 3 O N N N N IC50 = 26.68 nM 423.52 CN(C)CCCOc1ccc(-c2cnc3c(-c4ccnc5ccccc45)cnn3c2)cc1 Homo sapiens CHEMBL3706170 single protein format
CHEMBL4281166 OBDepict NH 2 S O O N N N N IC50 = 27.0 nM 483.6 NS(=O)(=O)c1ccc(-c2cnn3cc(-c4ccc(CN5CCCC5)cc4)cnc23)c2ccccc12 Homo sapiens CHEMBL4263977 single protein format
CHEMBL4642622 OBDepict CH 3 O O CH 3 O H 3 C N CH 3 N O IC50 = 28.0 nM 420.51 COc1cc(-c2cncc(-c3ccc(N4CCOCC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4797111 OBDepict CH 3 O N N N H N N N N N IC50 = 28.9 nM 496.62 COCCN1CCN(c2ccc(Nc3nccc(-c4c(-c5cccnc5)nn5c4CCC5)n3)cc2)CC1 Homo sapiens CHEMBL4714250 single protein format
CHEMBL4283315 OBDepict CH 3 H 2 N CH 3 N N N S O O NH 2 IC50 = 29.0 nM 457.56 CC(C)(N)c1ccc(-c2cnc3c(-c4ccc(S(N)(=O)=O)c5ccccc45)cnn3c2)cc1 Homo sapiens CHEMBL4263977 single protein format
CHEMBL4638544 OBDepict CH 3 O O H 3 C O H 3 C N H 3 C N N S O O CH 3 IC50 = 29.0 nM 497.62 COc1cc(-c2cncc(-c3ccc(N4CCN(S(C)(=O)=O)CC4)cc3)c2C)cc(OC)c1OC Homo sapiens CHEMBL4626169 single protein format
CHEMBL4781201 OBDepict CH 3 O F O CH 3 H 2 N N N NH IC50 = 29.0 nM 408.48 COc1cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2N)cc(F)c1OC Homo sapiens CHEMBL4771084 single protein format
CHEMBL4779127 OBDepict CH 3 O N H S O O CH 3 CH 3 N N HN IC50 = 31.0 nM 452.58 COc1cc(NS(C)(=O)=O)cc(-c2cc(-c3ccc(N4CCNCC4)cc3)cnc2C)c1 Homo sapiens CHEMBL4771084 single protein format
CHEMBL4244382 OBDepict O N N N N O IC50 = 32.0 nM 434.5 O=c1c2cc(-c3ccnc4ccccc34)ccc2ncn1-c1ccc(N2CCOCC2)cc1 Homo sapiens CHEMBL4235462 assay format
CHEMBL502351 OBDepict CH 3 O N N N N IC50 = 32.0 nM 352.4 COc1ccc(-c2cnc3c(-c4cccc5ncccc45)cnn3c2)cc1 Homo sapiens CHEMBL2390524 single protein format
CHEMBL4786529 OBDepict F F N N H 3 C N N HN IC50 = 32.2 nM 455.51 Cc1cc(-c2cnc3cc(-c4ccc(N5CCNCC5)cc4)ccn23)c2cc(F)cc(F)c2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL511563 OBDepict CH 3 O N N N N IC50 = 33.3 nM 352.4 COc1ccc(-c2cnc3c(-c4ccnc5ccccc45)cnn3c2)cc1 Homo sapiens CHEMBL2390524 single protein format
CHEMBL1230714 OBDepict H 3 C O O CH 3 O CH 3 NH 2 N HO IC50 = 35.0 nM 352.39 COc1cc(-c2cc(-c3cccc(O)c3)cnc2N)cc(OC)c1OC Homo sapiens CHEMBL3365510 single protein format
CHEMBL4757547 OBDepict CH 3 N N N N H 3 C N NH IC50 = 37.0 nM 474.61 Cc1cc(-c2cnc3cc(-c4cnc(N5CCC6(CCCN6)C5)c(C)c4)ccn23)c2ccccc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4784557 OBDepict CH 3 N N N N CH 3 N F IC50 = 38.1 nM 451.55 Cc1cc(-c2cnc3cc(-c4ccc(N5CCN(C)CC5)cc4)ccn23)c2ccc(F)cc2n1 Homo sapiens CHEMBL4727748 single protein format
CHEMBL4637817 OBDepict H 3 C O O CH 3 N CH 3 N NH IC50 = 39.0 nM 389.5 COc1cc(OC)cc(-c2cncc(-c3ccc(N4CCNCC4)cc3)c2C)c1 Homo sapiens CHEMBL4626169 single protein format
CHEMBL513147 OBDepict HN N N N N N IC50 = 40.7 nM 406.49 c1ccc2c(-c3cnn4cc(-c5ccc(N6CCNCC6)cc5)cnc34)ccnc2c1 Homo sapiens CHEMBL2390524 single protein format