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P30291 | WEE1_HUMAN | Wee1-like protein kinase (WEE1)

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
CHEMBL4454675 OBDepict H 3 C N N H N N N O Cl Cl Ki = 0.2 nM 518.45 CN1Cc2cc(Nc3ncc4c(=O)c(-c5c(Cl)cccc5Cl)cn(C5CC5)c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL4388515 assay format
CHEMBL4441166 OBDepict H 3 C N N H N N N H 3 C O Cl Cl Ki = 0.2 nM 492.41 CN1Cc2cc(Nc3ncc4c(=O)c(-c5c(Cl)cccc5Cl)cn(C)c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL4388515 assay format
CHEMBL4544916 OBDepict CH 3 N N N H N N N O Cl Cl Ki = 0.2 nM 557.49 CN1CCN(c2ccc(Nc3ncc4c(=O)c(-c5c(Cl)cccc5Cl)cn(-c5ccccc5)c4n3)cc2)CC1 Homo sapiens CHEMBL4388515 assay format
CHEMBL4562919 OBDepict CH 3 N N N H N N N O OH H 3 C H 3 C Cl Cl Ki = 0.2 nM 553.49 CN1CCN(c2ccc(Nc3ncc4c(=O)c(-c5c(Cl)cccc5Cl)cn(CC(C)(C)O)c4n3)cc2)CC1 Homo sapiens CHEMBL4388515 assay format
CHEMBL4529353 OBDepict HO N N O N N H Cl Cl N CH 3 Ki = 0.3 nM 508.41 CN1Cc2cc(Nc3ncc4c(=O)n(-c5c(Cl)cccc5Cl)cc(CO)c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL4388515 assay format
CHEMBL4444364 OBDepict CH 2 N N O N N H Cl Cl N CH 3 Ki = 0.3 nM 504.42 C=Cc1cn(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc4c(c3)CN(C)CC43CC3)nc12 Homo sapiens CHEMBL4388515 assay format
CHEMBL4554796 OBDepict CH 3 N N O N N H Cl Cl N CH 3 Ki = 0.3 nM 506.44 CCn1cc(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc4c(c3)CN(C)CC43CC3)nc21 Homo sapiens CHEMBL4388515 assay format
CHEMBL4443172 OBDepict CH 3 N N N H N N N CH 3 O Cl Cl Ki = 0.3 nM 495.41 CN1CCN(c2ccc(Nc3ncc4c(=O)c(-c5c(Cl)cccc5Cl)cn(C)c4n3)cc2)CC1 Homo sapiens CHEMBL4388515 assay format
CHEMBL4526423 OBDepict CH 3 N N H N N CH 3 O N Cl Cl Ki = 0.5 nM 492.41 Cc1cn(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc4c(c3)CN(C)CC43CC3)nc12 Homo sapiens CHEMBL4388515 assay format
CHEMBL4470852 OBDepict H 3 C N N H N N N H O Cl Cl Ki = 0.6 nM 478.38 CN1Cc2cc(Nc3ncc4c(=O)c(-c5c(Cl)cccc5Cl)c[nH]c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL4388515 assay format
CHEMBL4447769 OBDepict CH 3 N N H N N O N F F Cl Cl Ki = 0.6 nM 528.39 CN1Cc2cc(Nc3ncc4c(=O)n(-c5c(Cl)cccc5Cl)cc(C(F)F)c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL4388515 assay format
CHEMBL4878479 OBDepict H 3 C N N O N N N N H N CH 3 H 3 C NH IC50 = 1.0 nM 480.58 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4(C)C)nc2n1-c1cccc(C2(C#N)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4551299 OBDepict CH 3 N N N H N N N O Cl Cl Ki = 1.0 nM 521.45 CN1CCN(c2ccc(Nc3ncc4c(=O)c(-c5c(Cl)cccc5Cl)cn(C5CC5)c4n3)cc2)CC1 Homo sapiens CHEMBL4388515 assay format
CHEMBL3355536 OBDepict H 3 C N N H N N N O N N Cl Cl Ki < 1.0 nM 518.41 CN1Cc2cc(Nc3ncc4c(=O)n(-c5c(Cl)cccc5Cl)c5nccn5c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL3355534 OBDepict CH 3 N N N H N N N O N N Cl Cl Ki < 1.0 nM 521.41 CN1CCN(c2ccc(Nc3ncc4c(=O)n(-c5c(Cl)cccc5Cl)c5nccn5c4n3)cc2)CC1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL3355533 OBDepict CH 3 N CH 3 CH 3 N H N N N O N N Cl Ki < 1.0 nM 485.98 CN1Cc2cc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)ccc2C(C)(C)C1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL3355537 OBDepict H 3 C N N H N N N O N N F Cl Ki < 1.0 nM 501.95 CN1Cc2cc(Nc3ncc4c(=O)n(-c5c(F)cccc5Cl)c5nccn5c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL3355538 OBDepict CH 3 N CH 3 CH 3 N H N N N O N N Cl Cl Ki < 1.0 nM 520.42 CN1Cc2cc(Nc3ncc4c(=O)n(-c5c(Cl)cccc5Cl)c5nccn5c4n3)ccc2C(C)(C)C1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL4873514 OBDepict CH 3 N N O N N N N H N HN IC50 = 1.0 nM 478.56 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CCNC43CC3)nc2n1-c1cccc(C2(C#N)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL3355539 OBDepict CH 3 N CH 3 CH 3 N H N N N O N N F Cl Ki = 1.1 nM 503.97 CN1Cc2cc(Nc3ncc4c(=O)n(-c5c(F)cccc5Cl)c5nccn5c4n3)ccc2C(C)(C)C1 Homo sapiens CHEMBL4388515 assay format
CHEMBL3355531 OBDepict CH 3 N N H N N N O N N Cl Ki = 1.2 nM 483.96 CN1Cc2cc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL4469678 OBDepict CH 3 N N N H N N N O O Cl Cl Ki = 1.3 nM 537.45 CN1CCN(c2ccc(Nc3ncc4c(=O)c(-c5c(Cl)cccc5Cl)cn(C5COC5)c4n3)cc2)CC1 Homo sapiens CHEMBL4388515 assay format
CHEMBL3355528 OBDepict CH 3 N N H N N N O N N Cl Ki = 1.6 nM 457.93 CN1CCc2ccc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)cc2C1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL3355535 OBDepict CH 3 N N N H N N N O N N F Cl Ki = 2.0 nM 504.96 CN1CCN(c2ccc(Nc3ncc4c(=O)n(-c5c(F)cccc5Cl)c5nccn5c4n3)cc2)CC1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL4861984 OBDepict CH 3 N N O N N N N H F HN IC50 = 2.0 nM 459.53 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1cccc(C2(CF)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4867107 OBDepict H 3 C N N N H N N CH 3 O N Cl Cl IC50 = 2.0 nM 495.41 Cc1cn(-c2c(Cl)cccc2Cl)c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc12 Homo sapiens CHEMBL4844304 single protein format
CHEMBL3355518 OBDepict H 3 C N N N H N N N O N N Cl Ki = 2.3 nM 486.97 CN1CCN(c2ccc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)cc2)CC1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL4861383 OBDepict H 2 C N N O N N N N H CH 3 OH H 3 C N N H 3 C IC50 = 2.3 nM 526.65 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)c(C)c3)nc2n1-c1ccc2c(n1)[C@](C)(O)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4865418 OBDepict H 2 C N N O N N N NH HO CH 3 CH 3 N CH 3 IC50 = 2.4 nM 497.6 C=CCn1c(=O)c2cnc(Nc3ccc4c(c3)CN(C)CC43CC3)nc2n1-c1cccc(C(C)(C)O)n1 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4875570 OBDepict CH 2 N N O N N N N H OH H 3 C H 3 C N H IC50 = 2.4 nM 457.54 C=CCn1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1cccc(C(C)(C)O)n1 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4871231 OBDepict H 2 C N N O N N N NH HO CH 3 CH 3 N H IC50 = 2.4 nM 483.58 C=CCn1c(=O)c2cnc(Nc3ccc4c(c3)CNCC43CC3)nc2n1-c1cccc(C(C)(C)O)n1 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4875039 OBDepict CH 2 N N O N N N N H OH H 3 C H 3 C N HO IC50 = 2.5 nM 501.59 C=CCn1c(=O)c2cnc(Nc3ccc4c(c3)CN(CCO)CC4)nc2n1-c1cccc(C(C)(C)O)n1 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4867211 OBDepict H 2 C N N O N N N NH HO F F F N H IC50 = 2.5 nM 549.56 C=CCn1c(=O)c2cnc(Nc3ccc4c(c3)CNCC43CC3)nc2n1-c1ccc2c(n1)[C@@](O)(C(F)(F)F)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4862622 OBDepict H 2 C N N O N N N N H OH CH 3 H 3 C N H 3 C IC50 = 2.6 nM 471.57 C=CCn1c(=O)c2cnc(Nc3ccc4c(c3)CN(C)CC4)nc2n1-c1cccc(C(C)(C)O)n1 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4856035 OBDepict CH 2 N N O N N N N H OH F F N N H 3 C IC50 = 2.6 nM 548.6 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@@](O)(C(F)F)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4874546 OBDepict CH 2 N N O N N N N H OH H 3 C N N H 3 C IC50 = 2.6 nM 564.69 C=CCn1c(=O)c2cnc(Nc3ccc4c(ccn4C4CCN(C)CC4)c3)nc2n1-c1ccc2c(n1)[C@@](O)(CC)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4849097 OBDepict H 2 C N N O N N N N H OH CH 3 H 3 C N H 3 C IC50 = 2.6 nM 471.57 C=CCn1c(=O)c2cnc(Nc3ccc4c(c3)CCN(C)C4)nc2n1-c1cccc(C(C)(C)O)n1 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4780868 OBDepict CH 2 N N O N N N N H OH H 3 C H 3 C N N O O H 3 C IC50 = 2.8 nM 544.62 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C(=O)OC)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1 Homo sapiens CHEMBL4775145 single protein format
CHEMBL4876612 OBDepict CH 2 N N O N N N N H OH N N H 3 C IC50 = 2.9 nM 538.66 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@](O)(C1CC1)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4848944 OBDepict N N N N N CH 3 CH 3 O N HN NH IC50 = 3.0 nM 466.55 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1cccc(C2(C#N)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4872553 OBDepict F N N N N CH 3 CH 3 O N HN N H IC50 = 3.0 nM 473.56 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4)nc2n1-c1cccc(C2(CF)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4853285 OBDepict CH 2 N N O N N N N H OH CH 3 CH 3 N N H 3 C IC50 = 3.1 nM 540.67 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)c(C)c3)nc2n1-c1ccc2c(n1)[C@@](O)(CC)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4847705 OBDepict H 2 C N N O N N N HN OH CH 3 N N CH 3 IC50 = 3.2 nM 526.65 C=CCn1c(=O)c2cnc(Nc3cccc(N4CCN(C)CC4)c3)nc2n1-c1ccc2c(n1)[C@@](O)(CC)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4866800 OBDepict CH 2 N N O N N N N H NH 2 CH 3 N N H 3 C IC50 = 3.2 nM 525.66 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@@](N)(CC)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4861351 OBDepict CH 2 N N O N N N N H OH CH 3 N HN IC50 = 3.2 nM 512.62 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCNCC4)cc3)nc2n1-c1ccc2c(n1)[C@@](O)(CC)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4865963 OBDepict CH 2 N N O N N N H CH 3 OH N N H 3 C IC50 = 3.3 nM 511.63 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(c1)[C@@](C)(O)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4853973 OBDepict CH 2 N N O N N N N H OH F F F N N H 3 C IC50 = 3.6 nM 566.59 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@](O)(C(F)(F)F)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4868683 OBDepict CH 2 N N O N N N N H OH CH 3 N N H 3 C IC50 = 3.7 nM 540.67 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@@](O)(CC)CCC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4857841 OBDepict H 2 C N N O N N N N H CH 3 OH N N H 3 C IC50 = 3.7 nM 526.65 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@](C)(O)CCC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4871593 OBDepict CH 2 N N O N N N N H OH CH 3 N N H 3 C IC50 = 3.9 nM 526.65 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)C(O)(CC)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4850280 OBDepict H 3 C N N O N N N N H N NH CH 3 H 3 C IC50 = 4.0 nM 480.58 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4(C)C)nc2n1-c1cccc(C2(C#N)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4866501 OBDepict H 3 C N N O N N N N H N NH IC50 = 4.0 nM 452.52 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1cccc(C2(C#N)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4861168 OBDepict CH 2 N N O N N N N H O CH 3 OH N N H 3 C IC50 = 4.6 nM 514.59 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@@](C)(O)CO2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4871803 OBDepict CH 2 N N O N N N N H CH 3 OH N N H 3 C IC50 = 4.8 nM 512.62 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@](C)(O)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4853172 OBDepict N H 3 C H 3 C N N F N N H 3 C O N N H CH 3 H 3 C NH IC50 = 5.0 nM 500.58 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4(C)C)nc2n1-c1nc(C(C)(C)C#N)ccc1F Homo sapiens CHEMBL4807218 assay format
CHEMBL4869534 OBDepict F N F H 3 C CH 3 N N N O N N H H 3 C H 3 C HN IC50 = 5.0 nM 505.57 CC(C)(F)c1nc(-n2c3nc(Nc4ccc5c(c4)CCNC5(C)C)ncc3c(=O)n2C2CC2)ccc1F Homo sapiens CHEMBL4807218 assay format
CHEMBL4879157 OBDepict CH 2 N N O N N N N H CH 3 OH N N H 3 C IC50 = 5.2 nM 512.62 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)[C@@](C)(O)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL1976040 OBDepict CH 2 N N O N N N N H OH H 3 C H 3 C N N H 3 C IC50 = 5.2 nM 500.61 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1cccc(C(C)(C)O)n1 Homo sapiens CHEMBL4233140 single protein format
CHEMBL3355532 OBDepict CH 3 N O N H N N N O N N Cl Ki = 5.4 nM 511.97 CC(=O)N1Cc2cc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)ccc2C2(CC2)C1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL3355522 OBDepict Cl N O N N N N N H N Ki = 5.5 nM 471.95 O=c1c2cnc(Nc3ccc(N4CCCCC4)cc3)nc2n2ccnc2n1-c1ccccc1Cl Homo sapiens CHEMBL3372984 single protein format
CHEMBL4853185 OBDepict CH 2 N N O N N N N H OH N N H 3 C IC50 = 5.7 nM 498.59 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)C(O)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL4873633 OBDepict F N F CH 3 CH 3 N N N H 3 C H 3 C O N N H NH IC50 = 6.0 nM 479.54 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4)nc2n1-c1ccc(F)c(C(C)(C)F)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL472542 OBDepict H 2 N O N HO O N H Cl O IC50 = 6.0 nM 433.85 NC(=O)CCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O Homo sapiens CHEMBL1000360 single protein format
CHEMBL3355525 OBDepict CH 3 N N N H N N N O N N Cl Ki = 6.2 nM 486.97 CN1CCN(c2cccc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)c2)CC1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL4874090 OBDepict CH 2 N N O N N N N H F F N N H 3 C IC50 = 6.4 nM 518.57 C=CCn1c(=O)c2cnc(Nc3ccc(N4CCN(C)CC4)cc3)nc2n1-c1ccc2c(n1)C(F)(F)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL3355524 OBDepict CH 3 N O N N H N N N O N N Cl Ki = 6.6 nM 514.98 CC(=O)N1CCN(c2ccc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)cc2)CC1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL4855347 OBDepict F N OH H 3 C H 3 C N N N CH 3 CH 3 O N N H H 3 C CH 3 HN IC50 = 7.0 nM 505.6 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4(C)C)nc2n1-c1ccc(F)c(C(C)(C)O)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4875604 OBDepict N CH 3 CH 3 N N F N N CH 3 CH 3 O N N H HN IC50 = 7.0 nM 486.56 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1nc(C(C)(C)C#N)ccc1F Homo sapiens CHEMBL4807218 assay format
CHEMBL471163 OBDepict HO N HO O N H Cl Cl O IC50 = 7.0 nM 455.3 O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCCO Homo sapiens CHEMBL1000360 single protein format
CHEMBL515352 OBDepict OH N O N H O HN O S Cl O O IC50 = 7.0 nM 574.01 O=C(CCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O)NS(=O)(=O)c1ccccc1 Homo sapiens CHEMBL1000360 single protein format
CHEMBL3355530 OBDepict Cl N O N N N N N H N CH 3 Ki = 7.4 nM 457.93 CN1CCCc2cc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)ccc21 Homo sapiens CHEMBL3372984 single protein format
CHEMBL4854253 OBDepict N N N N N O F F F N N H N H IC50 = 8.0 nM 506.49 N#CC1(c2cccc(-n3c4nc(Nc5ccc6c(c5)CNCC6)ncc4c(=O)n3CC(F)(F)F)n2)CC1 Homo sapiens CHEMBL4807218 assay format
CHEMBL471157 OBDepict OH N O N H OH Cl Cl O IC50 = 8.0 nM 441.27 O=C1NC(=O)c2c1c(-c1c(Cl)cccc1Cl)cc1c2c2cc(O)ccc2n1CCO Homo sapiens CHEMBL1000360 single protein format
CHEMBL4877216 OBDepict F N HO CH 3 CH 3 N N N H 3 C H 3 C O N N H NH IC50 = 8.0 nM 477.54 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1ccc(F)c(C(C)(C)O)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4848860 OBDepict CH 3 N N O N N N N H F OH CH 3 H 3 C HN IC50 = 8.0 nM 463.52 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1ccc(F)c(C(C)(C)O)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL3355523 OBDepict H 3 C N N H N N N O N N Cl Ki = 8.3 nM 485.98 CN1CCC(c2ccc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)cc2)CC1 Homo sapiens CHEMBL3372984 single protein format
CHEMBL3355529 OBDepict CH 3 N N H N N N O N N Cl Ki = 8.6 nM 457.93 CN1CCCc2ccc(Nc3ncc4c(=O)n(-c5ccccc5Cl)c5nccn5c4n3)cc21 Homo sapiens CHEMBL3372984 single protein format
CHEMBL472208 OBDepict OH N O NH + S O _ O N N Cl N H IC50 = 9.0 nM 505.94 O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CC[S+]([O-])c1nnc[nH]1 Homo sapiens CHEMBL1000360 single protein format
CHEMBL4870383 OBDepict N N N N N CH 3 CH 3 O N HN N H IC50 = 9.0 nM 466.55 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4)nc2n1-c1cccc(C2(C#N)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL459889 OBDepict HO O N HO O N H Cl O IC50 = 9.0 nM 434.84 O=C(O)CCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O Homo sapiens CHEMBL1000360 single protein format
CHEMBL486517 OBDepict OH N O NH + S O N _ O N Cl N IC50 = 9.0 nM 505.94 O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CC[S+]([O-])n1ccnn1 Homo sapiens CHEMBL1006579 single protein format
CHEMBL411662 OBDepict OH N OH O N H Cl O IC50 = 9.0 nM 420.85 O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)ccc2n1CCCO Homo sapiens CHEMBL949042 single protein format
CHEMBL4852195 OBDepict CH 3 N N O N N N N H F OH CH 3 H 3 C HN IC50 = 9.0 nM 463.52 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4)nc2n1-c1ccc(F)c(C(C)(C)O)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4872330 OBDepict N N N N N H 3 C H 3 C O N NH CH 3 CH 3 N H IC50 = 10.0 nM 494.6 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4(C)C)nc2n1-c1cccc(C2(C#N)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL379975 OBDepict HO N H O N H O Cl IC50 = 11.0 nM 362.77 O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1[nH]c3ccc(O)cc3c21 Homo sapiens CHEMBL864855 single protein format
CHEMBL213585 OBDepict HO N H O N H O Cl OH IC50 = 12.0 nM 378.77 O=C1NC(=O)c2c1c(-c1cccc(O)c1Cl)cc1[nH]c3ccc(O)cc3c21 Homo sapiens CHEMBL864855 single protein format
CHEMBL4856253 OBDepict H 2 C N N O N N N HN OH CH 3 N N CH 3 N H 3 C IC50 = 12.0 nM 579.71 C=CCn1c(=O)c2cnc(Nc3cc(N4CCN(C)CC4)c4ccn(C)c4c3)nc2n1-c1ccc2c(n1)[C@@](O)(CC)CC2 Homo sapiens CHEMBL4844304 single protein format
CHEMBL460940 OBDepict O N H S O O CH 3 N HO O HN Cl O IC50 = 12.0 nM 511.94 CS(=O)(=O)NC(=O)CCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O Homo sapiens CHEMBL1000360 single protein format
CHEMBL215815 OBDepict HO N H O N H O I IC50 = 13.0 nM 454.22 O=C1NC(=O)c2c1c(-c1ccccc1I)cc1[nH]c3ccc(O)cc3c21 Homo sapiens CHEMBL864855 single protein format
CHEMBL4878169 OBDepict H 3 C N N O N N N N H N NH IC50 = 13.0 nM 452.52 CCn1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4)nc2n1-c1cccc(C2(C#N)CC2)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4852723 OBDepict F N F CH 3 CH 3 N N N H 3 C H 3 C O N N H NH IC50 = 13.0 nM 479.54 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CNCC4)nc2n1-c1ccc(F)c(C(C)(C)F)n1 Homo sapiens CHEMBL4807218 assay format
CHEMBL4865933 OBDepict N CH 3 CH 3 N N F N N CH 3 CH 3 O N N H HN IC50 = 13.0 nM 486.56 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4)nc2n1-c1nc(C(C)(C)C#N)ccc1F Homo sapiens CHEMBL4807218 assay format
CHEMBL511992 OBDepict HO O N HO O N H Cl O IC50 = 13.0 nM 448.86 O=C(O)CCCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O Homo sapiens CHEMBL1000360 single protein format
CHEMBL461116 OBDepict CH 3 N CH 3 N H O N OH O N H Cl Cl O IC50 = 14.0 nM 539.42 CN(C)CCNC(=O)CCn1c2ccc(O)cc2c2c3c(c(-c4c(Cl)cccc4Cl)cc21)C(=O)NC3=O Homo sapiens CHEMBL1000360 single protein format
CHEMBL472689 OBDepict O N H OH N N CH 3 O HN O Cl IC50 = 15.0 nM 512.95 Cn1c2cc(C(=O)NCCn3cccc3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O Homo sapiens CHEMBL1006579 single protein format
CHEMBL4855151 OBDepict N N N N N CH 3 CH 3 O N HN N H IC50 = 15.0 nM 466.55 CC(C)n1c(=O)c2cnc(Nc3ccc4c(c3)CCNC4)nc2n1-c1ccnc(C2(C#N)CC2)c1 Homo sapiens CHEMBL4807218 assay format
CHEMBL511280 OBDepict N N OH O N H Cl O IC50 = 15.0 nM 415.84 N#CCCn1c2ccc(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O Homo sapiens CHEMBL1000360 single protein format
CHEMBL272267 OBDepict O N H OH N N CH 3 O HN O Cl IC50 = 15.0 nM 516.99 Cn1c2cc(C(=O)NCCN3CCCC3)c(O)cc2c2c3c(c(-c4ccccc4Cl)cc21)C(=O)NC3=O Homo sapiens CHEMBL949042 single protein format
CHEMBL271715 OBDepict OH N O HO O N H Cl O N O IC50 = 15.0 nM 550.01 O=C1NC(=O)c2c1c(-c1ccccc1Cl)cc1c2c2cc(O)c(OCCCN3CCOCC3)cc2n1CCO Homo sapiens CHEMBL949042 single protein format
CHEMBL215485 OBDepict H 3 C O Cl N O N H H O HO IC50 = 15.0 nM 392.8 COc1cccc(Cl)c1-c1cc2[nH]c3ccc(O)cc3c2c2c1C(=O)NC2=O Homo sapiens CHEMBL864855 single protein format