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Q9UDY8 | MALT1_HUMAN | Mucosa-associated lymphoid tissue lymphoma translocation protein 1 (MALT1)

3D structures mapped by conservation among orthologs

[ Domain: "DEATH domain" // Death ]

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[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // I-set_4 ]

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[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // I-set_2 ]

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[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // EUF07710 ]

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[ Domain: "Caspase-like" // Peptidase_C14 ]

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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
CHEMBL3806155 OBDepict CH 3 O H 3 C H N NH N N N H O Cl N N F F F N N IC50 = 0.023 nM 481.83 CO[C@@H](C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(C(F)(F)F)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL3807231 cell-based format
CHEMBL3805390 OBDepict H 3 C O N N H N N N H O Cl N Cl N N N IC50 = 0.028 nM 488.34 COCC(c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2cc(Cl)nn12)C1CC1 Homo sapiens CHEMBL3807231 cell-based format
CHEMBL3806279 OBDepict CH 3 O H 3 C H N HN N N N H O CH 3 N F F F IC50 = 0.052 nM 394.36 CO[C@@H](C)c1c(NC(=O)Nc2cncc(C(F)(F)F)c2)cnc2cc(C)nn12 Homo sapiens CHEMBL3807231 cell-based format
CHEMBL3806235 OBDepict O N H N H N N N O N N F F F Cl N N IC50 = 0.094 nM 493.84 O=C(Nc1cnc(-n2nccn2)c(C(F)(F)F)c1)Nc1cnc2cc(Cl)nn2c1C1CCCO1 Homo sapiens CHEMBL3807231 cell-based format
CHEMBL3806299 OBDepict NH 2 N N Cl N H NH O N N CH 3 CH 3 N Cl IC50 = 0.134 nM 459.34 CC(C)c1c(NC(=O)Nc2ccc(-n3cc(CN)cn3)c(Cl)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL3807231 cell-based format
CHEMBL3805576 OBDepict O N H N H N N N CH 3 H 3 C N N F F F Cl S O O IC50 = 0.248 nM 517.92 CC(C)c1c(NC(=O)Nc2cnc(N3CCCS3(=O)=O)c(C(F)(F)F)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL3807231 cell-based format
CHEMBL4784740 OBDepict O N H HN N N Cl N Cl N N IC50 = 2.0 nM 440.29 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)Nc1cnc2ccc(Cl)cc2c1C1CC1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4781879 OBDepict CH 3 O H 3 C H N NH N N N H O Cl N Cl N N N IC50 = 3.0 nM 462.3 COC[C@H](C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4745946 OBDepict O N H N H N N N CH 3 H 3 C N Cl N Cl N N IC50 = 3.0 nM 432.28 CC(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4746044 OBDepict CH 3 O H 3 C H N HN N N N H O Cl N F F F IC50 = 4.0 nM 414.78 CO[C@@H](C)c1c(NC(=O)Nc2ccnc(C(F)(F)F)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4128769 OBDepict O N H N N Cl N N Cl N N IC50 = 4.0 nM 418.29 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)C1CCN(c2ncccc2Cl)CC1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4760571 OBDepict CH 3 O H 3 C H N NH N N N H O Cl N Cl N N N IC50 = 4.0 nM 462.3 COC[C@@H](C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4786953 OBDepict O N H NH N N N N Cl N Cl N N IC50 = 5.0 nM 430.26 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)Nc1cnc2cc(Cl)nn2c1C1CC1 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4748253 OBDepict H 3 C O CH 3 H N HN N N N H O Cl N Cl N N N IC50 = 6.0 nM 448.27 CO[C@@H](C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4741853 OBDepict O N H HN N N Cl N F N N IC50 = 6.0 nM 423.84 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)Nc1cnc2ccc(F)cc2c1C1CC1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4128888 OBDepict O N H N N Cl N N H 2 N N N IC50 = 7.0 nM 398.86 Nc1cccnc1N1CCC(C(=O)Nc2cnc(-n3nccn3)c(Cl)c2)CC1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4762086 OBDepict O N H NH N N Cl N N N IC50 = 7.0 nM 405.85 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)Nc1cnc2ccccc2c1C1CC1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4779581 OBDepict O N H N H N N OH H 3 C Cl N F N N IC50 = 7.0 nM 427.83 CC(O)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccc(F)cc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4591083 OBDepict CH 3 O Cl N H O H N H H 3 C N Br Ki = 9.6 nM 438.75 COc1ccc(NC(=O)[C@@H]2CCN(c3ncccc3Br)[C@H](C)C2)cc1Cl Homo sapiens CHEMBL4364166 cell-based format
CHEMBL4763128 OBDepict O N H N H N N N N Cl N O Cl N N IC50 = 10.0 nM 474.31 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)Nc1cnc2cc(Cl)nn2c1C1CCOCC1 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4591083 OBDepict CH 3 O Cl N H O H N H H 3 C N Br IC50 = 10.0 nM 438.75 COc1ccc(NC(=O)[C@@H]2CCN(c3ncccc3Br)[C@H](C)C2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4127375 OBDepict CH 3 O N Cl N H O N N Cl IC50 = 13.0 nM 381.26 COc1ncc(NC(=O)C2CCN(c3ncccc3Cl)CC2)cc1Cl Homo sapiens CHEMBL4122924 single protein format
CHEMBL4740000 OBDepict CH 3 O N HN N H O N Cl N N N IC50 = 13.0 nM 435.88 COc1ccc2ncc(NC(=O)Nc3cnc(-n4nccn4)c(Cl)c3)c(C3CC3)c2c1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4787356 OBDepict H 3 C O CH 3 H N HN N N N H O Cl N Cl N N N IC50 = 13.0 nM 448.27 CO[C@H](C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4784806 OBDepict O N H NH N N H 3 C CH 3 N N F F F Cl IC50 = 15.0 nM 398.78 CC(C)c1c(NC(=O)Nc2ccnc(C(F)(F)F)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4795308 OBDepict CH 3 O N HN N N N H O Cl N Cl N N N IC50 = 18.0 nM 434.25 COCc1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4705922 single protein format
CHEMBL4791759 OBDepict CH 3 O CH 3 NH N N H O F N Cl N N N IC50 = 18.0 nM 441.85 COC(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccc(F)cc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4559304 OBDepict O NH O Cl HN O N N Cl IC50 = 20.0 nM 421.28 O=C1COc2c(Cl)cc(NC(=O)C3CCN(c4ncccc4Cl)CC3)cc2N1 Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4129385 OBDepict H 3 C NH O N N N Cl N H O N N Cl IC50 = 21.0 nM 474.35 CNC(=O)c1ncn(-c2ccc(NC(=O)C3CCN(c4ncccc4Cl)CC3)cc2Cl)n1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4786633 OBDepict O N H N H H O Cl N Br N N IC50 = 26.0 nM 448.71 O=C(Nc1ccc(-n2cncn2)c(Cl)c1)N[C@H]1COc2ccc(Br)cc2C1 Homo sapiens CHEMBL4678245 single protein format
CHEMBL4749826 OBDepict CH 3 O CH 3 HN N N H O F N Cl N N N IC50 = 27.0 nM 455.88 CCOC(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccc(F)cc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4128618 OBDepict O N H N Cl N F Cl IC50 = 28.0 nM 368.24 O=C(Nc1ccc(F)c(Cl)c1)C1CCN(c2ncccc2Cl)CC1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4751498 OBDepict O N H N H N N HO CH 3 Cl N N N IC50 = 28.0 nM 409.84 CC(O)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccccc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4749854 OBDepict H 3 C O CH 3 HN N N S N H O CH 3 N Cl N N N IC50 = 30.0 nM 444.91 COC(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2sc(C)nc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4443047 OBDepict CH 3 O N Cl N H O N N Br IC50 = 30.0 nM 425.71 COc1ncc(NC(=O)C2CCN(c3ncccc3Br)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4747104 OBDepict CH 3 O N Cl N H N H O O Br IC50 = 31.0 nM 412.67 COc1ncc(NC(=O)NC2COc3ccc(Br)cc3C2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL4790415 OBDepict CH 3 O CH 3 NH N N H O N Cl N N N IC50 = 33.0 nM 423.86 COC(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccccc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4789469 OBDepict CH 3 O CH 3 H 3 C NH N N H O F N Cl N N N IC50 = 35.0 nM 455.88 COC(C)(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccc(F)cc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4130251 OBDepict O N H N Cl N N H 2 N N N IC50 = 35.0 nM 397.87 Nc1cccnc1N1CCC(C(=O)Nc2ccc(-n3nccn3)c(Cl)c2)CC1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4784899 OBDepict CH 3 O CH 3 HN N N S N H O CH 3 N Cl N N N IC50 = 36.0 nM 458.94 CCOC(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2sc(C)nc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4796575 OBDepict CH 3 O N Cl N H N H O N N H CH 3 O N IC50 = 37.0 nM 452.9 COc1ncc(NC(=O)Nc2cnc3ccc(C#N)cc3c2N2CCOC[C@@H]2C)cc1Cl Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4461333 OBDepict F O N H H O H N N H O HN NH 2 N H H CH 3 H 3 C O O Ki = 40.0 nM 520.61 CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)CF Homo sapiens CHEMBL4341484 single protein format
CHEMBL4470809 OBDepict O HN N N Cl N O Cl IC50 = 40.0 nM 407.3 O=C(Nc1cnc(OC2CC2)c(Cl)c1)C1CCN(c2ncccc2Cl)CC1 Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4794268 OBDepict O N H N H N N N Cl S N CH 3 N N IC50 = 46.0 nM 426.89 Cc1nc2c(C3CC3)c(NC(=O)Nc3cnc(-n4nccn4)c(Cl)c3)cnc2s1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4761510 OBDepict CH 3 O Cl N H N H O O Br IC50 = 50.0 nM 411.68 COc1ccc(NC(=O)NC2COc3ccc(Br)cc3C2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL4534539 OBDepict CH 3 O Cl N H O N N Br IC50 = 50.0 nM 424.73 COc1ccc(NC(=O)C2CCN(c3ncccc3Br)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4556101 OBDepict CH 3 O Cl N H O N CH 3 N Br IC50 = 50.0 nM 438.75 COc1ccc(NC(=O)C2CCN(c3ncccc3Br)C(C)C2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4551225 OBDepict CH 3 O Cl N H O N CH 3 N CH 3 IC50 = 50.0 nM 373.88 COc1ccc(NC(=O)C2CCN(c3ncccc3C)C(C)C2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4128008 OBDepict O N H N Cl N CH 3 Cl IC50 = 54.0 nM 364.28 Cc1ccc(NC(=O)C2CCN(c3ncccc3Cl)CC2)cc1Cl Homo sapiens CHEMBL4122924 single protein format
CHEMBL4763765 OBDepict CH 3 O CH 3 HN N N H O N Cl N N N IC50 = 55.0 nM 437.89 CCOC(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccccc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4751838 OBDepict CH 3 O Cl N H N H O O F IC50 = 57.0 nM 350.78 COc1ccc(NC(=O)NC2COc3ccc(F)cc3C2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL4788571 OBDepict O N H NH N N OH H 3 C N Cl S N CH 3 N N IC50 = 69.0 nM 430.88 Cc1nc2c(C(C)O)c(NC(=O)Nc3cnc(-n4nccn4)c(Cl)c3)cnc2s1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4758420 OBDepict H 3 C N O N Cl NH NH O N N H H 3 C F O IC50 = 70.0 nM 529.02 C[C@H]1COCCN1c1c(NC(=O)Nc2cnc(OC3CCN(C)CC3)c(Cl)c2)cnc2ccc(F)cc12 Homo sapiens CHEMBL4678245 single protein format
CHEMBL4756634 OBDepict CH 3 O N Cl N H N H O N N H 3 C N F CH 3 IC50 = 70.0 nM 472.95 COc1ncc(NC(=O)Nc2cnc3ccc(F)cc3c2N(C)C2CCCN(C)C2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL4742156 OBDepict O N H N H N N H 3 C CH 3 Cl N N N IC50 = 78.0 nM 407.87 CC(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccccc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4757361 OBDepict CH 3 O N Cl N H NH O N N N N H 3 C CH 3 Cl O IC50 = 80.0 nM 466.33 COc1ncc(NC(=O)Nc2cnc3cc(Cl)nn3c2N2CCOCC2(C)C)cc1Cl Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4740768 OBDepict O N H HN N N Cl N N N F IC50 = 92.0 nM 423.84 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)Nc1cnc2cc(F)ccc2c1C1CC1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4129988 OBDepict O N H N Cl N F H 2 N IC50 = 100.0 nM 348.81 Nc1cccnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4127369 OBDepict O N H N Cl N F Cl N IC50 = 100.0 nM 369.23 O=C(Nc1ccc(F)c(Cl)c1)C1CCN(c2nccnc2Cl)CC1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4446759 OBDepict CH 3 O Cl N H O N N CH 3 IC50 = 100.0 nM 359.86 COc1ccc(NC(=O)C2CCN(c3ncccc3C)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4546577 OBDepict CH 3 O Cl N H O N N Cl IC50 = 100.0 nM 380.27 COc1ccc(NC(=O)C2CCN(c3ncccc3Cl)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4471046 OBDepict O HN N Cl N O Cl IC50 = 100.0 nM 390.27 O=C(Nc1cc(Cl)c2occc2c1)C1CCN(c2ncccc2Cl)CC1 Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4765158 OBDepict CH 3 O Cl N H N H O N N H CH 3 O N IC50 = 120.0 nM 451.91 COc1ccc(NC(=O)Nc2cnc3ccc(C#N)cc3c2N2CCOC[C@@H]2C)cc1Cl Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4565085 OBDepict O N H N N Cl N O Cl N IC50 = 130.0 nM 444.32 O=C(Nc1cnc(Oc2cccnc2)c(Cl)c1)C1CCN(c2ncccc2Cl)CC1 Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4460951 OBDepict CH 3 O N Cl N H O N N Cl IC50 = 130.0 nM 381.26 COc1cnc(NC(=O)C2CCN(c3ncccc3Cl)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4764115 OBDepict H 3 C O Cl N H N H O H O IC50 = 135.0 nM 332.79 COc1ccc(NC(=O)N[C@H]2COc3ccccc3C2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL4742888 OBDepict CH 3 O Cl N H N H O S F IC50 = 145.0 nM 366.85 COc1ccc(NC(=O)NC2CSc3ccc(F)cc3C2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL4783666 OBDepict CH 3 O Cl N H N H O O N IC50 = 150.0 nM 357.8 COc1ccc(NC(=O)NC2COc3ccc(C#N)cc3C2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL4437710 OBDepict CH 3 O Cl N H O H N H H 3 C N Br IC50 = 150.0 nM 438.75 COc1ccc(NC(=O)[C@@H]2CCN(c3ncccc3Br)[C@@H](C)C2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4796225 OBDepict O NH N H N N N N N H H 3 C H CH 3 F F F Cl O IC50 = 160.0 nM 469.86 C[C@H]1COC[C@H](C)N1c1c(NC(=O)Nc2ccnc(C(F)(F)F)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4759864 OBDepict O N H N H N CH 3 N Cl N Br N N IC50 = 160.0 nM 458.71 Cc1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccc(Br)cc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4755479 OBDepict CH 3 O CH 3 H 3 C NH N N H O N Cl N N N IC50 = 165.0 nM 437.89 COC(C)(C)c1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccccc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4550900 OBDepict CH 3 O Cl N H O H N H H 3 C N Br IC50 = 180.0 nM 438.75 COc1ccc(NC(=O)[C@H]2CCN(c3ncccc3Br)[C@H](C)C2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4125938 OBDepict O N H N Cl N N + N N O _ O CH 3 N CH 3 IC50 = 184.0 nM 455.91 Cc1nc(C)n(-c2ccc(NC(=O)C3CCN(c4ncccc4[N+](=O)[O-])CC3)cc2Cl)n1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4748505 OBDepict CH 3 O N Cl N H N H O N N H 3 C O N IC50 = 190.0 nM 466.93 COc1ncc(NC(=O)Nc2cnc3ccc(C#N)cc3c2N(C)C2CCOCC2)cc1Cl Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4127519 OBDepict O N H N Cl N Cl IC50 = 210.0 nM 350.25 O=C(Nc1cccc(Cl)c1)C1CCN(c2ncccc2Cl)CC1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4556123 OBDepict CH 3 O Cl N H O CH 3 N N CH 3 IC50 = 230.0 nM 373.88 COc1ccc(NC(=O)C2CCN(c3ncccc3C)CC2C)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4541376 OBDepict CH 3 O Cl N H O N Cl IC50 = 230.0 nM 379.29 COc1ccc(NC(=O)C2CCN(c3ccccc3Cl)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4782908 OBDepict O N H N H N CH 3 N Cl N N N IC50 = 237.0 nM 379.81 Cc1c(NC(=O)Nc2cnc(-n3nccn3)c(Cl)c2)cnc2ccccc12 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4754209 OBDepict CH 3 O Cl N H N H O N Br IC50 = 242.0 nM 406.67 COc1ccc(NC(=O)Nc2cnc3ccc(Br)cc3c2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL1336903 OBDepict CH 3 O Cl N H N H O O IC50 = 245.0 nM 332.79 COc1ccc(NC(=O)NC2COc3ccccc3C2)cc1Cl Homo sapiens CHEMBL4678245 single protein format
CHEMBL4795909 OBDepict O HN N H N N N N N H 3 C CH 3 F F F Cl O IC50 = 280.0 nM 469.86 CC1(C)COCCN1c1c(NC(=O)Nc2ccnc(C(F)(F)F)c2)cnc2cc(Cl)nn12 Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4476038 OBDepict H 3 C H N H N N H O CH 3 Cl O H 3 C IC50 = 290.0 nM 387.91 CC[C@@H]1C[C@H](C(=O)Nc2ccc(OC)c(Cl)c2)CCN1c1ncccc1C Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4754690 OBDepict H 3 C O N Cl N H HN O N N N N H CH 3 H H 3 C Cl O IC50 = 330.0 nM 466.33 COc1ncc(NC(=O)Nc2cnc3cc(Cl)nn3c2N2[C@@H](C)COC[C@@H]2C)cc1Cl Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4129254 OBDepict CH 3 N N HN F F F O N N Cl IC50 = 340.0 nM 463.89 Cc1cn(-c2cc(NC(=O)C3CCN(c4ncccc4Cl)CC3)cc(C(F)(F)F)c2)cn1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4525068 OBDepict CH 3 O Cl N H O N N O CH 3 IC50 = 350.0 nM 375.86 COc1ccc(NC(=O)C2CCN(c3ncccc3OC)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL3632807 OBDepict O O O H 3 C H 3 C + N O _ O IC50 = 400.0 nM 287.27 CC1(C)CCC2=C(O1)c1ccc([N+](=O)[O-])cc1C(=O)C2=O Homo sapiens CHEMBL3635350 single protein format
CHEMBL4594202 OBDepict CH 3 O Cl N H O N N F F F IC50 = 410.0 nM 413.83 COc1ccc(NC(=O)C2CCN(c3ncccc3C(F)(F)F)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL395110 OBDepict CH 3 N N S IC50 = 420.0 nM 310.47 CN1CCCC(CN2c3ccccc3Sc3ccccc32)C1 Homo sapiens CHEMBL3816160 single protein format
CHEMBL4128693 OBDepict N N N N H O Cl F IC50 = 420.0 nM 358.8 N#Cc1cccnc1N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 Homo sapiens CHEMBL4122924 single protein format
CHEMBL4784606 OBDepict O N H HN N N Cl N N N Cl IC50 = 432.0 nM 440.29 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)Nc1cnc2cc(Cl)ccc2c1C1CC1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4760252 OBDepict O N H N H N N Cl N N N IC50 = 451.0 nM 433.9 O=C(Nc1cnc(-n2nccn2)c(Cl)c1)Nc1cnc2ccccc2c1C1CCCC1 Homo sapiens CHEMBL4667669 single protein format
CHEMBL4866278 OBDepict H 3 C N CH 3 N H O N N Cl Cl IC50 = 490.0 nM 403.31 CN(C)CCNC(=O)c1cc(-c2ccc(Cl)cc2)n(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL4818044 single protein format
CHEMBL4798110 OBDepict CH 3 O Cl N H N H O N Cl Br IC50 = 510.0 nM 441.11 COc1ccc(NC(=O)Nc2cnc3ccc(Br)cc3c2Cl)cc1Cl Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4847984 OBDepict Cl N N N H O Cl N CH 3 IC50 = 521.0 nM 443.38 CN1CCCCC1CNC(=O)c1cc(-c2ccc(Cl)cc2)n(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL4818044 single protein format
CHEMBL4537193 OBDepict O NH O HN O N N Cl IC50 = 540.0 nM 386.84 O=C1COc2ccc(NC(=O)C3CCN(c4ncccc4Cl)CC3)cc2N1 Homo sapiens CHEMBL4364157 cell-based format
CHEMBL4442542 OBDepict CH 3 O Cl N H O N N Cl CH 3 IC50 = 550.0 nM 394.3 COc1ccc(NC(=O)C2CCN(c3nc(C)ccc3Cl)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format
CHEMBL2036880 OBDepict CH 3 O O O O H 3 C H 3 C IC50 = 600.0 nM 272.3 COc1ccc2c(c1)C(=O)C(=O)C1=C2OC(C)(C)CC1 Homo sapiens CHEMBL3635350 single protein format
CHEMBL4785146 OBDepict CH 3 O Cl N H N H O N N H 3 C O N IC50 = 670.0 nM 465.94 COc1ccc(NC(=O)Nc2cnc3ccc(C#N)cc3c2N(C)C2CCOCC2)cc1Cl Homo sapiens CHEMBL4678226 cell-based format
CHEMBL4567817 OBDepict CH 3 O Cl NH O N N S IC50 = 690.0 nM 401.92 COc1ccc(NC(=O)C2CCN(c3nccc4sccc34)CC2)cc1Cl Homo sapiens CHEMBL4364157 cell-based format