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Q02127 | PYRD_HUMAN | "Dihydroorotate dehydrogenase (quinone), mitochondrial" (DHODH)

3D structures mapped by conservation among orthologs

[ Domain: "TIM barrels" // DHO_dh ]

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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
CHEMBL4744558 OBDepict H 3 C O NH O H 3 C N F F IC50 = 0.12 nM 404.42 CONC(=O)c1c(C)c(-c2ccc(-c3ccccc3F)cc2)nc2ccc(F)cc12 Homo sapiens CHEMBL4703073 single protein format
CHEMBL4751541 OBDepict OH N N N CH 3 O F N CH 2 H 3 C O F IC50 < 0.169 nM 438.43 C=C(C)c1cn(-c2ccccc2F)c(=O)c2cc(F)c(-n3nc(CO)n(CC)c3=O)cc12 Homo sapiens CHEMBL4679826 assay format
CHEMBL4854356 OBDepict CH 3 N N O N HO N F O N H 3 C H N O F F F F Cl IC50 = 0.2 nM 546.84 CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c3c(Oc4c(F)cccc4Cl)nncc3c2F)c1=O Homo sapiens CHEMBL4834033 single protein format
CHEMBL4791380 OBDepict CH 3 N N O N HO F N H 3 C CH 3 O F Cl IC50 = 0.222 nM 474.9 CCn1c(CO)nn(-c2cc3c(C(C)C)cn(-c4c(F)cccc4Cl)c(=O)c3cc2F)c1=O Homo sapiens CHEMBL4679826 assay format
CHEMBL4753279 OBDepict OH N N N CH 3 O F N CH 2 H 3 C O CH 3 F IC50 = 0.249 nM 452.46 C=C(C)c1cn(-c2cc(F)ccc2C)c(=O)c2cc(F)c(-n3nc(CO)n(CC)c3=O)cc12 Homo sapiens CHEMBL4679826 assay format
CHEMBL4745588 OBDepict CH 3 N N O N OH F N CH 2 H 3 C O F Cl IC50 = 0.265 nM 472.88 C=C(C)c1cn(-c2c(F)cccc2Cl)c(=O)c2cc(F)c(-n3nc(CO)n(CC)c3=O)cc12 Homo sapiens CHEMBL4679826 assay format
CHEMBL4752247 OBDepict H 3 C O Cl N F O H 2 C CH 3 F N N O N OH CH 3 IC50 = 0.267 nM 502.91 C=C(C)c1cn(-c2c(F)ccc(OC)c2Cl)c(=O)c2cc(F)c(-n3nc(CO)n(CC)c3=O)cc12 Homo sapiens CHEMBL4679826 assay format
CHEMBL4852401 OBDepict CH 3 O Cl O F N O N H 3 C H N F F F O N OH CH 3 IC50 = 0.3 nM 556.9 CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c3c(Oc4c(F)ccc(OC)c4Cl)nccc3c2)c1=O Homo sapiens CHEMBL4834033 single protein format
CHEMBL4851260 OBDepict CH 3 N N O N HO N F O N H 3 C H N N H F F F F Cl IC50 = 0.38 nM 545.86 CCn1c(CO)nn(-c2nc(O[C@@H](C)C(F)(F)F)c3c(Nc4c(F)cccc4Cl)nncc3c2F)c1=O Homo sapiens CHEMBL4834033 single protein format
CHEMBL4751399 OBDepict OH N N N H 3 C O F N H 3 C CH 3 O CH 3 IC50 = 0.396 nM 436.49 CCn1c(CO)nn(-c2cc3c(C(C)C)cn(-c4ccccc4C)c(=O)c3cc2F)c1=O Homo sapiens CHEMBL4679826 assay format
CHEMBL4859161 OBDepict OH N N N H 3 C O O H 3 C H N O F F F F Cl N CH 3 H 3 C IC50 = 0.4 nM 569.94 CCn1c(CO)nn(-c2cc(O[C@@H](C)C(F)(F)F)c3c(Oc4c(F)ccc(N(C)C)c4Cl)nccc3c2)c1=O Homo sapiens CHEMBL4834033 single protein format
CHEMBL4647465 OBDepict F N F N N N O CH 3 H 3 C O IC50 = 0.5 nM 430.41 CN(C)c1cccc(-c2c(F)cc(-n3nnc4c3C(=O)c3ccccc3C4=O)cc2F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL4857243 OBDepict H 3 C N N O N OH N F O CH 3 N O F F F F Cl IC50 = 0.59 nM 545.85 CCn1c(CO)nn(-c2nc(OC(C)C(F)(F)F)c3c(Oc4c(F)cccc4Cl)nccc3c2F)c1=O Homo sapiens CHEMBL4834033 single protein format
CHEMBL3974614 OBDepict OH O N H O N O H HO NH 2 IC50 = 0.97 nM 397.43 NCCO.O=C(O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3879555 single protein format
CHEMBL4760820 OBDepict H 3 C N CH 3 N O HO N H CH 3 IC50 = 1.0 nM 345.4 Cc1nc2c(C(=O)O)cc(-c3ccc(-n4c(C)ccc4C)cc3)cc2[nH]1 Homo sapiens CHEMBL4731343 single protein format
CHEMBL4743372 OBDepict F F F F N N O OH N H CH 3 F F IC50 = 1.0 nM 533.47 Cc1nc2c(C(=O)O)cc(-c3c(F)c(F)c(-c4ccc(CN5CCCC(F)(F)C5)cc4)c(F)c3F)cc2[nH]1 Homo sapiens CHEMBL4731343 single protein format
CHEMBL4793981 OBDepict F F F F N O HO N H CH 3 IC50 = 1.0 nM 400.33 Cc1nc2c(C(=O)O)cc(-c3c(F)c(F)c(-c4ccccc4)c(F)c3F)cc2[nH]1 Homo sapiens CHEMBL4731343 single protein format
CHEMBL4798243 OBDepict CH 3 N O HO N H CH 3 IC50 = 1.0 nM 342.4 Cc1cccc(-c2ccc(-c3cc(C(=O)O)c4nc(C)[nH]c4c3)cc2)c1 Homo sapiens CHEMBL4731343 single protein format
CHEMBL199361 OBDepict CH 3 O F F F F N H O S O OH IC50 = 1.0 nM 425.36 COc1ccccc1-c1c(F)c(F)c(NC(=O)c2ccsc2C(=O)O)c(F)c1F Homo sapiens CHEMBL863437 single protein format
CHEMBL2385512 OBDepict F N O OH CH 3 CH 3 H 3 C O IC50 = 1.0 nM 415.46 Cc1cc(Oc2ccccc2)c(C(C)C)cc1-c1cc(C(=O)O)c2cc(F)ccc2n1 Homo sapiens CHEMBL2388704 single protein format
CHEMBL4761259 OBDepict HO O N N CH 3 H N IC50 = 1.0 nM 411.51 Cc1nc2c(C(=O)O)cc(-c3ccc(-c4ccccc4CN4CCCC4)cc3)cc2[nH]1 Homo sapiens CHEMBL4731343 single protein format
CHEMBL4635115 OBDepict OH F F F N N N O O IC50 = 1.2 nM 435.36 O=C1c2ccccc2C(=O)c2c1nnn2-c1cc(F)c(-c2cc(CO)ccc2F)c(F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL4638219 OBDepict O N H N O H N N H 3 C IC50 = 1.2 nM 376.46 Cc1ccccc1-n1ncc2c1CCC[C@H]2NC(=O)c1noc2c1CCCC2 Homo sapiens CHEMBL4615013 single protein format
CHEMBL4637493 OBDepict OH F F N N N O O IC50 = 1.2 nM 417.37 O=C1c2ccccc2C(=O)c2c1nnn2-c1cc(F)c(-c2cccc(CO)c2)c(F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL4173846 OBDepict F N H F F O F HO N N IC50 = 1.2 nM 401.32 O=C(Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F)c1c(O)nn2ccccc12 Homo sapiens CHEMBL4137384 assay format
CHEMBL4759615 OBDepict OH HN O CH 3 N F F IC50 = 1.4 nM 390.39 Cc1c(-c2ccc(-c3ccccc3F)cc2)nc2ccc(F)cc2c1C(=O)NO Homo sapiens CHEMBL4703073 single protein format
CHEMBL4580266 OBDepict F F N H F F O O S F F F O OH IC50 = 1.5 nM 479.33 O=C(Nc1c(F)c(F)c(-c2cccc(OC(F)(F)F)c2)c(F)c1F)c1ccsc1C(=O)O Homo sapiens CHEMBL4403481 single protein format
CHEMBL4647629 OBDepict CH 3 O F F N N N O O IC50 = 1.6 nM 431.4 COCc1cccc(-c2c(F)cc(-n3nnc4c3C(=O)c3ccccc3C4=O)cc2F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL39448 OBDepict HO O CH 3 N Ki = 1.7 nM 339.39 Cc1c(-c2ccc(-c3ccccc3)cc2)nc2ccccc2c1C(=O)O Homo sapiens CHEMBL669211 assay format
CHEMBL3959360 OBDepict F O HO N N CH 3 S N Cl IC50 = 2.0 nM 389.84 CN(/N=C/c1ccc(F)cc1C(=O)O)c1nc(-c2ccccc2Cl)cs1 Homo sapiens CHEMBL3862079 single protein format
CHEMBL3674660 OBDepict HO O N H N F F F IC50 = 2.0 nM 398.38 O=C(O)c1cc(C2CC2)ccc1Nc1cnc(-c2ccccc2)c(C(F)(F)F)c1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL202431 OBDepict F N H F O O S O OH F F F IC50 = 2.0 nM 443.35 O=C(Nc1c(F)cc(-c2cccc(OC(F)(F)F)c2)cc1F)c1ccsc1C(=O)O Homo sapiens CHEMBL859133 single protein format
CHEMBL4637894 OBDepict O N H N N H N N F IC50 = 2.3 nM 379.44 O=C(N[C@@H]1CCCc2c1cnn2-c1ccccc1F)c1ncn2c1CCCC2 Homo sapiens CHEMBL4615074 single protein format
CHEMBL4637264 OBDepict O N H N O N N H 3 C CH 3 IC50 = 2.7 nM 390.49 Cc1cccc(-n2ncc3c2CCCC3NC(=O)c2noc3c2CCCC3)c1C Homo sapiens CHEMBL4615013 single protein format
CHEMBL4645385 OBDepict F F F N N N O O IC50 = 2.7 nM 405.33 O=C1c2ccccc2C(=O)c2c1nnn2-c1cc(F)c(-c2cccc(F)c2)c(F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL2263625 OBDepict CH 3 O F F F F N H N O HO IC50 = 3.0 nM 392.31 COc1cccc(-c2c(F)c(F)c(Nc3ncccc3C(=O)O)c(F)c2F)c1 Homo sapiens CHEMBL3705188 single protein format
CHEMBL3674666 OBDepict HO O N H N N Cl IC50 = 3.0 nM 365.82 O=C(O)c1cc(C2CC2)ccc1Nc1cnc(-c2ccccc2Cl)nc1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL3677808 OBDepict H 3 C N N O HO CH 3 F F F F IC50 = 3.0 nM 414.36 Cc1cc(C(=O)O)c2c(c1)nc(-c1c(F)c(F)c(-c3ccccc3)c(F)c1F)n2C Homo sapiens CHEMBL3706259 single protein format
CHEMBL200699 OBDepict CH 3 O F F N H O S O HO IC50 = 3.0 nM 403.41 CCOc1cccc(-c2cc(F)c(NC(=O)c3ccsc3C(=O)O)c(F)c2)c1 Homo sapiens CHEMBL863437 single protein format
CHEMBL4641822 OBDepict NH 2 N N N O O IC50 = 3.1 nM 366.38 Nc1cccc(-c2ccc(-n3nnc4c3C(=O)c3ccccc3C4=O)cc2)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL3639766 OBDepict CH 3 N O OH N H F F F F F IC50 = 3.5 nM 418.32 Cc1cc(C(=O)O)c2nc(-c3c(F)c(F)c(-c4ccccc4F)c(F)c3F)[nH]c2c1 Homo sapiens CHEMBL3706259 single protein format
CHEMBL4644761 OBDepict O N H N O N N H 3 C IC50 = 3.8 nM 376.46 Cc1ccccc1-n1ncc2c1CCCC2NC(=O)c1noc2c1CCCC2 Homo sapiens CHEMBL4615013 single protein format
CHEMBL143628 OBDepict Cl N N N H O N H O Ki = 4.0 nM 430.89 O=C(NCc1ccccc1)c1cc(C(=O)Nc2ccccc2)n(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL665409 single protein format
CHEMBL341925 OBDepict Cl N N N H O N H O N Ki = 4.0 nM 431.88 O=C(NCc1cccnc1)c1cc(C(=O)Nc2ccccc2)n(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL665409 single protein format
CHEMBL194955 OBDepict O N H S O HO F F F F O F F F IC50 = 4.0 nM 481.35 O=C(O)C1=C(C(=O)Nc2c(F)c(F)c(-c3cccc(OC(F)(F)F)c3)c(F)c2F)CSC1 Homo sapiens CHEMBL879486 single protein format
CHEMBL2263646 OBDepict F N H F N O O HO F F F IC50 = 4.0 nM 450.36 O=C(O)c1cc(C2CC2)cnc1Nc1c(F)cc(-c2cccc(OC(F)(F)F)c2)cc1F Homo sapiens CHEMBL3705188 single protein format
CHEMBL3674663 OBDepict HO O N H N Cl IC50 = 4.0 nM 364.83 O=C(O)c1cc(C2CC2)ccc1Nc1ccc(-c2ccccc2Cl)nc1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL2263449 OBDepict F N H F H 3 C N Cl O OH IC50 = 4.0 nM 374.77 Cc1c(-c2ccccc2Cl)cc(F)c(Nc2ncccc2C(=O)O)c1F Homo sapiens CHEMBL3705188 single protein format
CHEMBL4633521 OBDepict CH 3 O N N N O O IC50 = 4.1 nM 381.39 COc1cc(-n2nnc3c2C(=O)c2ccccc2C3=O)ccc1-c1ccccc1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL3966747 OBDepict HO O N H O N O H HO NH 2 IC50 = 4.14 nM 421.45 NCCO.O=C(O)c1[nH]c(=O)[nH]c(=O)c1CCc1cc2ccccc2c2ccccc12 Homo sapiens CHEMBL3879555 single protein format
CHEMBL4797708 OBDepict CH 3 O N H O H 3 C N F F IC50 = 4.2 nM 418.44 CCONC(=O)c1c(C)c(-c2ccc(-c3ccccc3F)cc2)nc2ccc(F)cc12 Homo sapiens CHEMBL4703073 single protein format
CHEMBL4165923 OBDepict F NH F F O F HO N N CH 3 IC50 = 4.3 nM 415.35 Cc1cccc2c(C(=O)Nc3c(F)c(F)c(-c4ccccc4)c(F)c3F)c(O)nn12 Homo sapiens CHEMBL4137384 assay format
CHEMBL50499 OBDepict F N O _ O H 3 C N + Na Ki = 4.5 nM 418.4 Cc1c(-n2ccc3c(-c4ccccc4)cccc32)nc2ccc(F)cc2c1C(=O)[O-].[Na+] Homo sapiens CHEMBL665414 assay format
CHEMBL4646288 OBDepict O N N N O F F F IC50 = 4.5 nM 405.33 O=C1c2ccccc2C(=O)c2c1nnn2-c1cc(F)c(-c2ccccc2F)c(F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL4638432 OBDepict F N N N O O IC50 = 4.5 nM 369.36 O=C1c2ccccc2C(=O)c2c1nnn2-c1ccc(-c2ccccc2F)cc1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL4633498 OBDepict H 3 C O O F F N N N O O IC50 = 4.6 nM 459.41 COC(=O)Cc1cccc(-c2c(F)cc(-n3nnc4c3C(=O)c3ccccc3C4=O)cc2F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL2263447 OBDepict F N H F N Cl O OH IC50 = 5.0 nM 400.81 O=C(O)c1cc(C2CC2)cnc1Nc1c(F)cc(-c2ccccc2Cl)cc1F Homo sapiens CHEMBL3705188 single protein format
CHEMBL3674655 OBDepict OH O N H N CH 3 O F F F IC50 = 5.0 nM 428.41 Cc1cc(Nc2ccc(C3CC3)cc2C(=O)O)cnc1-c1cccc(OC(F)(F)F)c1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL41719 OBDepict F N O HO HO IC50 = 5.0 nM 359.36 O=C(O)c1c(O)c(-c2ccc(-c3ccccc3)cc2)nc2ccc(F)cc12 Homo sapiens CHEMBL855443 assay format
CHEMBL3674658 OBDepict CH 3 N H O HO N H 3 C F IC50 = 5.0 nM 336.37 Cc1ccc(Nc2cnc(-c3ccccc3F)c(C)c2)c(C(=O)O)c1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL2263644 OBDepict F N H F CH 3 N O HO IC50 = 5.0 nM 340.33 Cc1c(-c2ccccc2)cc(F)c(Nc2ncccc2C(=O)O)c1F Homo sapiens CHEMBL3705188 single protein format
CHEMBL4639751 OBDepict HO N N N OH F F F IC50 = 5.1 nM 409.37 OC1c2ccccc2C(O)c2c1nnn2-c1cc(F)c(-c2ccccc2F)c(F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL3677767 OBDepict CH 3 N N O OH H F F F F N CH 3 CH 3 IC50 = 5.6 nM 417.36 Cc1cc(C(=O)O)c2[nH]c(-c3c(F)c(F)c(-n4c(C)ccc4C)c(F)c3F)nc2c1 Homo sapiens CHEMBL3706259 single protein format
CHEMBL3901542 OBDepict CH 3 O N N H O OH H O HO NH 2 IC50 = 5.77 nM 335.36 Cc1ccc(CCc2c(C(=O)O)[nH]c(=O)[nH]c2=O)cc1.NCCO Homo sapiens CHEMBL3879555 single protein format
CHEMBL342220 OBDepict Cl N N N H O N H O O H 2 N Ki = 6.0 nM 473.92 NC(=O)c1ccc(NC(=O)c2cc(C(=O)NCc3ccccc3)nn2-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL665409 single protein format
CHEMBL2263645 OBDepict F N H F N O O OH IC50 = 6.0 nM 422.43 O=C(O)c1cc(C2CC2)cnc1Nc1c(F)cc(-c2cccc(OC3CC3)c2)cc1F Homo sapiens CHEMBL3705188 single protein format
CHEMBL3674656 OBDepict OH O N H N CH 3 IC50 = 6.0 nM 344.41 Cc1cc(Nc2ccc(C3CC3)cc2C(=O)O)cnc1-c1ccccc1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL2263448 OBDepict F N H F CH 3 N O O HO F F F IC50 = 6.0 nM 424.33 Cc1c(-c2cccc(OC(F)(F)F)c2)cc(F)c(Nc2ncccc2C(=O)O)c1F Homo sapiens CHEMBL3705188 single protein format
CHEMBL218062 OBDepict OH N OH O OH IC50 = 6.0 nM 357.37 O=C(O)c1c(O)c(-c2ccc(-c3ccc(O)cc3)cc2)nc2ccccc12 Homo sapiens CHEMBL855443 assay format
CHEMBL218084 OBDepict F N O HO HO O IC50 = 6.0 nM 375.36 O=C(O)c1c(O)c(-c2ccc(Oc3ccccc3)cc2)nc2ccc(F)cc12 Homo sapiens CHEMBL855443 assay format
CHEMBL4640411 OBDepict F N N H N H O N N IC50 = 6.3 nM 375.41 O=C(N[C@@H]1CCCc2c1cnn2-c1ccccc1F)c1ncc2ccccn12 Homo sapiens CHEMBL4615013 single protein format
CHEMBL3677748 OBDepict CH 3 N O OH N H F F F F IC50 = 6.8 nM 400.33 Cc1cc(C(=O)O)c2nc(-c3c(F)c(F)c(-c4ccccc4)c(F)c3F)[nH]c2c1 Homo sapiens CHEMBL3706259 single protein format
CHEMBL4632909 OBDepict F F F N N N O O IC50 = 6.9 nM 405.33 O=C1c2ccccc2C(=O)c2c1nnn2-c1cc(F)c(-c2ccc(F)cc2)c(F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL218169 OBDepict HO O OH N O IC50 = 7.0 nM 357.37 O=C(O)c1c(O)c(-c2ccc(Oc3ccccc3)cc2)nc2ccccc12 Homo sapiens CHEMBL855443 assay format
CHEMBL154623 OBDepict O N H O HO F F F F O F F F IC50 = 7.0 nM 463.31 O=C(O)C1=C(C(=O)Nc2c(F)c(F)c(-c3cccc(OC(F)(F)F)c3)c(F)c2F)CCC1 Homo sapiens CHEMBL665412 single protein format
CHEMBL220467 OBDepict F N O HO H 3 C IC50 = 7.0 nM 357.38 Cc1c(-c2ccc(-c3ccccc3)cc2)nc2ccc(F)cc2c1C(=O)O Homo sapiens CHEMBL855443 assay format
CHEMBL3674661 OBDepict CH 3 O N F F F N H O HO IC50 = 7.0 nM 428.41 COc1cccc(-c2ncc(Nc3ccc(C4CC4)cc3C(=O)O)cc2C(F)(F)F)c1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL4644297 OBDepict O N H O N H N N H 3 C IC50 = 7.0 nM 376.46 Cc1ccccc1-n1ncc2c1CCC[C@H]2NC(=O)c1onc2c1CCCC2 Homo sapiens CHEMBL4615013 single protein format
CHEMBL386159 OBDepict OH N OH O OH F IC50 = 7.0 nM 375.36 O=C(O)c1c(O)c(-c2ccc(-c3ccc(O)cc3)cc2)nc2ccc(F)cc12 Homo sapiens CHEMBL855443 assay format
CHEMBL4759152 OBDepict F N N O H 3 C OH CH 3 F IC50 = 7.7 nM 404.42 Cc1c(-c2ccc(-c3ccccc3F)cc2)nc2ccc(F)cc2c1C(=O)N(C)O Homo sapiens CHEMBL4703073 single protein format
CHEMBL288708 OBDepict F N O _ O H 3 C + Na Ki = 8.0 nM 379.37 Cc1c(-c2ccc(-c3ccccc3)cc2)nc2ccc(F)cc2c1C(=O)[O-].[Na+] Homo sapiens CHEMBL669211 assay format
CHEMBL142444 OBDepict Cl N N N H O N H O N N Ki = 8.0 nM 515.02 O=C(NCc1cccnc1)c1cc(C(=O)Nc2ccc(N3CCCCC3)cc2)n(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL665409 single protein format
CHEMBL345701 OBDepict CH 3 O F F F F N H O O OH IC50 = 8.0 nM 409.34 COc1ccccc1-c1c(F)c(F)c(NC(=O)C2=C(C(=O)O)CCC2)c(F)c1F Homo sapiens CHEMBL665412 single protein format
CHEMBL3922925 OBDepict CH 3 O HO N N CH 3 S N Cl IC50 = 8.0 nM 385.88 Cc1ccc(/C=N/N(C)c2nc(-c3ccccc3Cl)cs2)c(C(=O)O)c1 Homo sapiens CHEMBL3862079 single protein format
CHEMBL3674675 OBDepict HO O N H N F IC50 = 8.0 nM 348.38 O=C(O)c1cc(C2CC2)ccc1Nc1ccc(-c2ccccc2F)nc1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL3980486 OBDepict CH 3 N N S N Cl O HO IC50 = 8.0 nM 371.85 CN(/N=C/c1ccccc1C(=O)O)c1nc(-c2ccccc2Cl)cs1 Homo sapiens CHEMBL3862079 single protein format
CHEMBL2259675 OBDepict Cl N N H O HO F F IC50 = 8.0 nM 360.75 O=C(O)c1cc(Cl)cnc1Nc1c(F)cc(-c2ccccc2)cc1F Homo sapiens CHEMBL3705188 single protein format
CHEMBL38434 OBDepict F N O HO H 3 C F IC50 = 8.0 nM 375.37 Cc1c(-c2ccc(-c3ccccc3F)cc2)nc2ccc(F)cc2c1C(=O)O Homo sapiens CHEMBL863437 single protein format
CHEMBL104209 OBDepict F N O _ O + Na Ki = 8.3 nM 391.38 O=C([O-])c1c2c(nc3ccc(F)cc13)-c1ccc(-c3ccccc3)cc1CC2.[Na+] Homo sapiens CHEMBL665413 single protein format
CHEMBL38692 OBDepict OH O H 3 C N F F F Ki = 8.4 nM 407.39 Cc1c(-c2ccc(-c3ccccc3)cc2)nc2ccc(C(F)(F)F)cc2c1C(=O)O Homo sapiens CHEMBL669211 assay format
CHEMBL3677811 OBDepict CH 3 N N O OH H F F F F F IC50 = 8.86 nM 418.32 Cc1cc(C(=O)O)c2[nH]c(-c3c(F)c(F)c(-c4cccc(F)c4)c(F)c3F)nc2c1 Homo sapiens CHEMBL3706259 single protein format
CHEMBL3909259 OBDepict CH 3 N N S N Cl O HO IC50 = 9.0 nM 399.9 CCCN(/N=C/c1ccccc1C(=O)O)c1nc(-c2ccccc2Cl)cs1 Homo sapiens CHEMBL3862079 single protein format
CHEMBL4648164 OBDepict H 3 C O F F N N N O O IC50 = 9.0 nM 417.37 COc1cccc(-c2c(F)cc(-n3nnc4c3C(=O)c3ccccc3C4=O)cc2F)c1 Homo sapiens CHEMBL4618428 single protein format
CHEMBL3674671 OBDepict HO O N H N N F F F IC50 = 9.0 nM 399.37 O=C(O)c1cc(C2CC2)ccc1Nc1cnc(-c2ccccc2C(F)(F)F)nc1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL4644015 OBDepict O N H N O H N N F IC50 = 9.0 nM 380.42 O=C(N[C@@H]1CCCc2c1cnn2-c1ccccc1F)c1noc2c1CCCC2 Homo sapiens CHEMBL4615013 single protein format
CHEMBL3674668 OBDepict CH 3 N H O HO N H 3 C N O IC50 = 9.0 nM 415.49 Cc1ccc(Nc2cnc(-c3cccc(C(=O)N4CCCC4)c3)c(C)c2)c(C(=O)O)c1 Homo sapiens CHEMBL3705342 single protein format
CHEMBL200856 OBDepict CH 3 O F F N H O S O HO IC50 = 9.0 nM 403.41 CCOc1ccccc1-c1cc(F)c(NC(=O)c2ccsc2C(=O)O)c(F)c1 Homo sapiens CHEMBL863437 single protein format
CHEMBL3818031 OBDepict CH 3 CH 3 N CH 3 O HO Br IC50 = 9.7 nM 398.3 CCC(C)c1ccc(-c2nc3ccc(Br)cc3c(C(=O)O)c2C)cc1 Homo sapiens CHEMBL3822209 assay format
CHEMBL4228712 OBDepict F N O HO H 3 C Cl N IC50 = 9.71 nM 392.82 Cc1c(-c2ccc(-c3cccnc3Cl)cc2)nc2ccc(F)cc2c1C(=O)O Homo sapiens CHEMBL4224224 assay format
CHEMBL290910 OBDepict CH 3 N O HO H 3 C Ki = 10.0 nM 353.42 Cc1ccc2nc(-c3ccc(-c4ccccc4)cc3)c(C)c(C(=O)O)c2c1 Homo sapiens CHEMBL669211 assay format