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Q13315 | ATM_HUMAN | Serine-protein kinase ATM (ATM)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // PI3_PI4_kinase ]

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[ Domain: "FATC domain" // UNK_F_TYPE ]

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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
CHEMBL4108514 OBDepict H 3 C O H H N O N CH 3 N N O N IC50 < 0.0525 nM 501.63 CO[C@@H]1CC[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN6CCCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4594429 OBDepict F N N N N O CH 3 H 3 C CH 3 O N IC50 = 0.09 nM 477.58 CC(C)n1c(=O)n(C)c2cnc3cc(F)c(-c4ccc(OCCCN5CCCCC5)nc4)cc3c21 Homo sapiens CHEMBL4775116 single protein format
CHEMBL4850755 OBDepict H N O N N N H O Ki = 0.1 nM 368.48 O=c1cc(N2CCOCC2)nc(N2CCCCC[C@@H]2Cc2ccccc2)[nH]1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL3923182 OBDepict H 3 C O H H N O N CH 3 N N O N CH 3 H 3 C IC50 = 0.152 nM 475.59 CO[C@H]1CC[C@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN(C)C)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3936943 OBDepict CH 3 O H H N O N H 3 C N N O N IC50 = 0.176 nM 487.6 CO[C@H]1C[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN6CCCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4858310 OBDepict H N O N N N H H H O Ki = 0.2 nM 352.44 O=c1cc(N2CCOCC2)nc(N2C[C@H]3C[C@H]3[C@@H]2Cc2ccccc2)[nH]1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL3960323 OBDepict CH 3 O H H N O N H 3 C N N O N IC50 = 0.2 nM 501.63 CO[C@H]1C[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN6CCCCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4115047 OBDepict H 3 C O H H N O N CH 3 N F N O N CH 3 H 3 C IC50 = 0.208 nM 493.58 CO[C@@H]1CC[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN(C)C)nc5F)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3952396 OBDepict CH 3 O H H N O N H 3 C N N N H N IC50 = 0.22 nM 514.67 CO[C@H]1CC[C@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(NCCCN6CCCCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4110135 OBDepict H 3 C N O N N H O N O N IC50 = 0.233 nM 487.6 Cn1c(=O)n([C@@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3947316 OBDepict H 3 C N O N N H O N O N IC50 = 0.238 nM 487.6 Cn1c(=O)n([C@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3889770 OBDepict H 3 C N CH 3 O N N N N H 3 C O H H HO IC50 = 0.24 nM 447.54 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@H]2C[C@@H](O)C2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3954517 OBDepict H 3 C N H O N N N N H 3 C O H H O CH 3 IC50 = 0.249 nM 447.54 CNCCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@H]2C[C@@H](OC)C2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3936734 OBDepict CH 3 O H H N O N H 3 C N N O N CH 3 CH 3 IC50 = 0.249 nM 461.57 CO[C@H]1C[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN(C)C)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3979811 OBDepict CH 3 O H H N O N H 3 C N N O N IC50 = 0.292 nM 473.58 CO[C@H]1C[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN6CCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4862803 OBDepict H N O N N H H H O Ki = 0.3 nM 351.45 O=c1cc(N2CCOCC2)cc(N2C[C@@H]3C[C@@H]3[C@@H]2Cc2ccccc2)[nH]1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL3927821 OBDepict H 3 C N CH 3 O N F N N N CH 3 O O IC50 = 0.301 nM 479.56 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCOCC2)c(=O)n4C)c(F)n1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3929864 OBDepict H 3 C O H H N O N CH 3 N F N O N CH 3 H 3 C IC50 = 0.31 nM 493.58 CO[C@H]1CC[C@H](n2c(=O)n(C)c3cnc4cc(F)c(-c5ccc(OCCCN(C)C)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3890876 OBDepict H 3 C N O N N N O N IC50 = 0.31 nM 457.58 Cn1c(=O)n(C2CCC2)c2c3cc(-c4ccc(OCCCN5CCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4112870 OBDepict H 3 C O H H N O N CH 3 N N O N CH 3 H 3 C IC50 = 0.315 nM 475.59 CO[C@@H]1CC[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN(C)C)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3898641 OBDepict H 3 C O H H N O N CH 3 N F N O N CH 3 H 3 C IC50 = 0.324 nM 493.58 CO[C@H]1CC[C@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN(C)C)nc5F)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3890490 OBDepict CH 3 N CH 3 O N N N N H 3 C O H O IC50 = 0.329 nM 461.57 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@H]2CCCOC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3904625 OBDepict H 3 C O H H N O N CH 3 N N O N IC50 = 0.334 nM 501.63 CO[C@H]1CC[C@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN6CCCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3935033 OBDepict CH 3 N CH 3 O N F N N N H 3 C O H O IC50 = 0.365 nM 479.56 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@H]2CCCOC2)c(=O)n4C)c(F)n1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4852400 OBDepict O N H N N N H O H H 3 C Ki = 0.4 nM 354.45 C[C@@H]1CCN(c2nc(N3CCOCC3)cc(=O)[nH]2)[C@H]1Cc1ccccc1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL3895211 OBDepict CH 3 O H H N O N H 3 C N F N O N IC50 = 0.418 nM 505.59 CO[C@H]1C[C@@H](n2c(=O)n(C)c3cnc4cc(F)c(-c5ccc(OCCCN6CCCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3970378 OBDepict O N N CH 3 N N O N IC50 = 0.434 nM 471.61 Cn1c(=O)n(C2CCC2)c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3898165 OBDepict H 3 C N O N N H H HO N O N IC50 = 0.447 nM 473.58 Cn1c(=O)n([C@H]2C[C@@H](O)C2)c2c3cc(-c4ccc(OCCCN5CCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3964241 OBDepict O N N CH 3 H N O N O N IC50 = 0.493 nM 487.6 Cn1c(=O)n([C@H]2CCOC2)c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4210045 OBDepict CH 3 N N H 3 C NH H 3 C H N N O NH 2 N O N IC50 = 0.5 nM 514.63 Cc1cn(C)nc1[C@H](C)Nc1c(C(N)=O)nnc2ccc(-c3ccc(OCCCN4CCCC4)nc3)cc12 Homo sapiens CHEMBL4200456 cell-based format
CHEMBL4781601 OBDepict O O N S O O O IC50 = 0.5 nM 491.61 O=c1cc(-c2cccc3c2Sc2ccc(OCC4CCOCC4)cc2C3)oc(N2CCOCC2)c1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4763842 OBDepict O O N S O N H CH 3 O IC50 = 0.5 nM 476.6 CC1(CNc2ccc3c(c2)Cc2cccc(-c4cc(=O)cc(N5CCOCC5)o4)c2S3)COC1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4792191 OBDepict O O N S O OH IC50 = 0.5 nM 393.46 O=c1cc(-c2cccc3c2Sc2ccc(O)cc2C3)oc(N2CCOCC2)c1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4763108 OBDepict O O N S O O N H H O IC50 = 0.5 nM 518.64 O=c1cc(-c2cccc3c2Sc2ccc(OCCN4C[C@H]5C[C@@H]4CO5)cc2C3)oc(N2CCOCC2)c1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4748079 OBDepict O O N S O O N F F IC50 = 0.5 nM 526.61 O=c1cc(-c2cccc3c2Sc2ccc(OCCN4CCC(F)(F)C4)cc2C3)oc(N2CCOCC2)c1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4788241 OBDepict O O N S O O N H H 3 C O H H 3 C IC50 = 0.5 nM 534.68 C[C@H]1CN(CCOc2ccc3c(c2)Cc2cccc(-c4cc(=O)cc(N5CCOCC5)o4)c2S3)C[C@@H](C)O1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4792737 OBDepict CH 3 O S O O N O Ki = 0.5 nM 407.49 COc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2 Homo sapiens CHEMBL4823699 single protein format
CHEMBL4114446 OBDepict H 3 C O H H N O N CH 3 N F N O N CH 3 H 3 C IC50 = 0.507 nM 493.58 CO[C@@H]1CC[C@@H](n2c(=O)n(C)c3cnc4cc(F)c(-c5ccc(OCCCN(C)C)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3932222 OBDepict CH 3 N CH 3 O N N N N H 3 C O H O IC50 < 0.534 nM 447.54 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@H]2CCOC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4109764 OBDepict CH 3 N CH 3 O N F N N N H 3 C O H O IC50 = 0.552 nM 479.56 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@@H]2CCCOC2)c(=O)n4C)c(F)n1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3906409 OBDepict F N O N N N N CH 3 O H O IC50 = 0.554 nM 505.59 Cn1c(=O)n([C@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCCC5)nc4F)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3890358 OBDepict CH 3 NH O N N N N H 3 C O H O IC50 = 0.555 nM 447.54 CNCCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@H]2CCCOC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3890119 OBDepict F N N N N O H 3 C O H O N IC50 = 0.563 nM 505.59 Cn1c(=O)n([C@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCCC5)nc4)c(F)cc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3984782 OBDepict CH 3 NH O N N N N H 3 C O O IC50 = 0.567 nM 447.54 CNCCCOc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCOCC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3960662 OBDepict H 3 C N CH 3 O N N N N CH 3 O O IC50 = 0.575 nM 461.57 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCOCC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3955034 OBDepict CH 3 O H H N O N H N N O N IC50 = 0.589 nM 473.58 CO[C@H]1C[C@@H](n2c(=O)[nH]c3cnc4ccc(-c5ccc(OCCCN6CCCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4114155 OBDepict CH 3 NH O N N N N H 3 C O H O IC50 = 0.592 nM 447.54 CNCCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@@H]2CCCOC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4745255 OBDepict O O N S O O H 3 C H N O IC50 = 0.6 nM 520.65 C[C@H](CN1CCOCC1)Oc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4786685 OBDepict F N O S O O N O IC50 = 0.6 nM 494.59 O=c1cc(-c2cccc3c2Sc2ccc(OCCN4CC(F)C4)cc2C3)oc(N2CCOCC2)c1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4763102 OBDepict O O N S O O OH CH 3 H IC50 = 0.6 nM 451.54 C[C@H](O)COc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4790714 OBDepict CH 3 NH O S O O N O IC50 = 0.6 nM 434.52 CC(=O)Nc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4794627 OBDepict O N H S O O N O IC50 = 0.6 nM 460.56 O=C(Nc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2)C1CC1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4857803 OBDepict H N O N N N H H H O Ki = 0.6 nM 352.44 O=c1cc(N2CCOCC2)nc(N2C[C@@H]3C[C@@H]3[C@@H]2Cc2ccccc2)[nH]1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL4114060 OBDepict F N N N N O H 3 C O H O N IC50 = 0.69 nM 505.59 Cn1c(=O)n([C@@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCCC5)nc4)c(F)cc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4777914 OBDepict CH 3 N N O S O O N O IC50 = 0.7 nM 519.67 CN1CCN(CCOc2ccc3c(c2)Cc2cccc(-c4cc(=O)cc(N5CCOCC5)o4)c2S3)CC1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4784220 OBDepict O O N S O O N CH 3 H O IC50 = 0.7 nM 520.65 C[C@@H](COc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2)N1CCOCC1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4783324 OBDepict O O N S O O N F F IC50 = 0.7 nM 540.63 O=c1cc(-c2cccc3c2Sc2ccc(OCCN4CCC(F)(F)CC4)cc2C3)oc(N2CCOCC2)c1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4110616 OBDepict O N N CH 3 H N O N O N IC50 = 0.715 nM 487.6 Cn1c(=O)n([C@@H]2CCOC2)c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3974856 OBDepict CH 3 N CH 3 O N F N N N H 3 C O IC50 = 0.722 nM 449.53 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n(C2CCC2)c(=O)n4C)c(F)n1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4115552 OBDepict CH 3 O H H N O N H 3 C N N N H N IC50 = 0.741 nM 514.67 CO[C@@H]1CC[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(NCCCN6CCCCC6)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3958682 OBDepict CH 3 O H H N O N H 3 C N F N O N CH 3 CH 3 IC50 = 0.765 nM 479.56 CO[C@H]1C[C@@H](n2c(=O)n(C)c3cnc4ccc(-c5ccc(OCCCN(C)C)nc5F)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3986918 OBDepict H 3 C N CH 3 O N F N N N CH 3 O O IC50 = 0.782 nM 479.56 CN(C)CCCOc1ccc(-c2cc3c(cc2F)ncc2c3n(C3CCOCC3)c(=O)n2C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3972724 OBDepict F N N N N O CH 3 O H O N IC50 = 0.799 nM 519.62 Cn1c(=O)n([C@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)c(F)cc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4109786 OBDepict CH 3 N O N N H O N O N IC50 = 0.84 nM 473.58 Cn1c(=O)n([C@@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4212961 OBDepict H 3 C N CH 3 O N N N H N H 3 C H O NH 2 N N CH 3 CH 3 IC50 = 0.9 nM 488.6 Cc1cn(C)nc1[C@H](C)Nc1c(C(N)=O)nnc2ccc(-c3ccc(OCCCN(C)C)nc3)cc12 Homo sapiens CHEMBL4200456 cell-based format
CHEMBL4853948 OBDepict H N O N N N H H H O H H 3 C Ki = 0.9 nM 366.46 C[C@@H]1CN(c2cc(=O)[nH]c(N3C[C@@H]4C[C@@H]4[C@@H]3Cc3ccccc3)n2)CCO1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL4111966 OBDepict CH 3 N CH 3 O N N N N H 3 C O H O IC50 = 0.935 nM 461.57 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@@H]2CCCOC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3961688 OBDepict CH 3 N CH 3 O N N N N H 3 C O H 3 C O IC50 = 0.96 nM 475.59 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n(C2(C)CCOCC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4872830 OBDepict H N O N N H O Ki = 1.0 nM 367.49 O=c1cc(N2CCOCC2)cc(N2CCCCC[C@@H]2Cc2ccccc2)[nH]1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL4761765 OBDepict O O N S O O N CH 3 H H H 3 C O H H 3 C IC50 = 1.0 nM 548.71 C[C@H]1CN([C@H](C)COc2ccc3c(c2)Cc2cccc(-c4cc(=O)cc(N5CCOCC5)o4)c2S3)C[C@@H](C)O1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4742203 OBDepict O O N S O O H 3 C H N O IC50 = 1.0 nM 520.65 C[C@@H](CN1CCOCC1)Oc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4797559 OBDepict O O N S O O N CH 3 H O IC50 = 1.0 nM 520.65 C[C@H](COc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2)N1CCOCC1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4110596 OBDepict CH 3 N CH 3 O N F N N N H 3 C O H O IC50 = 1.0 nM 479.56 CN(C)CCCOc1ccc(-c2cc3c(cc2F)ncc2c3n([C@@H]3CCCOC3)c(=O)n2C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4751373 OBDepict O O N S O O H 3 C H N O O IC50 = 1.0 nM 562.69 C[C@@H](CN1CCOCC12COC2)Oc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4752634 OBDepict H 3 C O O H 3 C H S O O N O IC50 = 1.0 nM 465.57 COC[C@@H](C)Oc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4760480 OBDepict O O N S O O O IC50 = 1.0 nM 449.53 O=c1cc(-c2cccc3c2Sc2ccc(OC4COC4)cc2C3)oc(N2CCOCC2)c1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4797110 OBDepict O O N S O O CH 3 H N H H O IC50 = 1.0 nM 532.66 C[C@@H](CN1C[C@H]2C[C@@H]1CO2)Oc1ccc2c(c1)Cc1cccc(-c3cc(=O)cc(N4CCOCC4)o3)c1S2 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4852763 OBDepict H N O N N N H O H CH 3 Ki = 1.0 nM 382.51 C[C@@H]1CN(c2cc(=O)[nH]c(N3CCCCC[C@@H]3Cc3ccccc3)n2)CCO1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL4845919 OBDepict H N O N N H O H CH 3 Ki = 1.0 nM 381.52 C[C@@H]1CN(c2cc(N3CCCCC[C@@H]3Cc3ccccc3)[nH]c(=O)c2)CCO1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL4878312 OBDepict OH N N N N H O Ki = 1.0 nM 340.43 Oc1cc(N2CCOCC2)nc(N2CCC[C@@H]2Cc2ccccc2)n1 Homo sapiens CHEMBL4823699 single protein format
CHEMBL3891448 OBDepict CH 3 N H 3 C O N F F N N N CH 3 O H O IC50 = 1.02 nM 497.55 CN(C)CCCOc1ccc(-c2cc3c(cc2F)ncc2c3n([C@H]3CCCOC3)c(=O)n2C)c(F)n1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3898563 OBDepict CH 3 O H H N O N H N N O N CH 3 CH 3 IC50 = 1.03 nM 447.54 CO[C@H]1C[C@@H](n2c(=O)[nH]c3cnc4ccc(-c5ccc(OCCCN(C)C)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3950905 OBDepict CH 3 O H H N O N H 3 C N F N O N CH 3 CH 3 IC50 = 1.05 nM 479.56 CO[C@H]1C[C@@H](n2c(=O)n(C)c3cnc4cc(F)c(-c5ccc(OCCCN(C)C)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3984179 OBDepict H 3 C N O N N H H HO N O N IC50 = 1.05 nM 459.55 Cn1c(=O)n([C@H]2C[C@@H](O)C2)c2c3cc(-c4ccc(OCCCN5CCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4110389 OBDepict CH 3 N CH 3 O N N N N H 3 C O H O IC50 = 1.07 nM 447.54 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@@H]2CCOC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3932205 OBDepict O N N CH 3 H N O N O N IC50 = 1.09 nM 501.63 Cn1c(=O)n([C@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4208569 OBDepict H 3 C N N NH H 3 C H N N O NH 2 N O N IC50 = 1.1 nM 500.61 C[C@H](Nc1c(C(N)=O)nnc2ccc(-c3ccc(OCCCN4CCCC4)nc3)cc12)c1ccn(C)n1 Homo sapiens CHEMBL4200456 cell-based format
CHEMBL3946515 OBDepict F N N N N O H 3 C O O N IC50 = 1.1 nM 519.62 Cn1c(=O)n(C2CCOCC2)c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)c(F)cc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3963290 OBDepict CH 3 N O N N O N O N IC50 = 1.12 nM 487.6 Cn1c(=O)n(C2CCOCC2)c2c3cc(-c4ccc(OCCCN5CCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3912673 OBDepict CH 3 N CH 3 O N F N N N H 3 C O H O IC50 = 1.14 nM 479.56 CN(C)CCCOc1ccc(-c2cc3c(cc2F)ncc2c3n([C@H]3CCCOC3)c(=O)n2C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3946340 OBDepict H 3 C N O N N O N O N IC50 = 1.2 nM 501.63 Cn1c(=O)n(C2CCOCC2)c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3912416 OBDepict CH 3 N O N N O N O N IC50 = 1.33 nM 473.58 Cn1c(=O)n(C2CCOCC2)c2c3cc(-c4ccc(OCCCN5CCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3955067 OBDepict H 3 C N CH 3 O N F N N N CH 3 O H O IC50 = 1.34 nM 465.53 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@H]2CCOC2)c(=O)n4C)c(F)n1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4756577 OBDepict O O N S O O N O IC50 = 1.4 nM 546.69 O=c1cc(-c2cccc3c2Sc2ccc(OCCN4CCCC45CCOC5)cc2C3)oc(N2CCOCC2)c1 Homo sapiens CHEMBL4682224 single protein format
CHEMBL4108353 OBDepict H 3 C N CH 3 O N F N N N CH 3 O H O IC50 = 1.44 nM 465.53 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n([C@@H]2CCOC2)c(=O)n4C)c(F)n1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3923162 OBDepict H 3 C O H H N O N CH 3 N F N O N CH 3 H 3 C IC50 = 1.45 nM 493.58 CO[C@@H]1CC[C@H](n2c(=O)n(C)c3cnc4cc(F)c(-c5ccc(OCCCN(C)C)nc5)cc4c32)C1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL3924247 OBDepict CH 3 N CH 3 O N N N N H 3 C O O IC50 = 1.46 nM 433.51 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3c2)n(C2COC2)c(=O)n4C)cn1 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4163629 OBDepict H 3 C N CH 3 O N N N N N CH 3 O O IC50 = 1.7 nM 462.55 CN(C)CCCOc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1 Homo sapiens CHEMBL4153770 cell-based format
CHEMBL4112039 OBDepict O N N CH 3 H N O N O N IC50 = 1.78 nM 501.63 Cn1c(=O)n([C@@H]2CCCOC2)c2c3cc(-c4ccc(OCCCN5CCCCC5)nc4)ccc3ncc21 Homo sapiens CHEMBL3888991 cell-based format
CHEMBL4213503 OBDepict NH 2 O N N HN CH 3 H O N O N IC50 = 1.8 nM 504.64 C[C@H](Nc1c(C(N)=O)nnc2ccc(-c3ccc(OCCCN4CCCC4)nc3)cc12)C1CCOCC1 Homo sapiens CHEMBL4200456 cell-based format