O75874 | IDHC_HUMAN | Isocitrate dehydrogenase [NADP] cytoplasmic (IDH1)
Pfam Domain Table
Accession | Domain | Range | Color |
---|---|---|---|
PF00180 | Iso_dh - Isocitrate/isopropylmalate dehydrogenase | 11~380 |
3D structures mapped by conservation among orthologs
[ Alpha Fold Model ] (go)
Known binders annotated in ChEMBL
molecule_chembl_id | structure | assay_type | relation | value | unit | mol_wt | smiles | organism | assay_chembl_id | bao_label |
---|---|---|---|---|---|---|---|---|---|---|
CHEMBL4279047 | IC50 | = | 0.04 | nM | 414.74 | C[C@@H](Nc1nc(N[C@H](C)C(F)(F)F)nc(-c2cccc(Cl)n2)n1)C(F)(F)F | Homo sapiens | CHEMBL4309377 | single protein format | |
CHEMBL4278845 | IC50 | = | 0.25 | nM | 414.74 | C[C@H](Nc1nc(N[C@@H](C)C(F)(F)F)nc(-c2cccc(Cl)n2)n1)C(F)(F)F | Homo sapiens | CHEMBL4338885 | assay format | |
CHEMBL4283785 | IC50 | = | 0.3 | nM | 414.74 | CC(Nc1nc(NC(C)C(F)(F)F)nc(-c2cccc(Cl)n2)n1)C(F)(F)F | Homo sapiens | CHEMBL4338885 | assay format | |
CHEMBL4280132 | IC50 | = | 0.7 | nM | 430.84 | FC1(F)CCC(Nc2nc(NC3CCC(F)(F)C3)nc(-c3cccc(Cl)n3)n2)C1 | Homo sapiens | CHEMBL4338885 | assay format | |
CHEMBL4277352 | IC50 | = | 1.0 | nM | 464.39 | FC1(F)CCC(Nc2nc(NC3CCC(F)(F)C3)nc(-c3cccc(C(F)(F)F)n3)n2)C1 | Homo sapiens | CHEMBL4338885 | assay format | |
CHEMBL3909586 | IC50 | = | 1.0 | nM | 446.43 | C[C@H](Nc1nccc(N2C(=O)OC[C@@H]2[C@H](C)F)n1)c1cn(-c2ccc(C(F)F)cc2)cn1 | Homo sapiens | CHEMBL3889082 | single protein format | |
CHEMBL4463644 | IC50 | = | 2.0 | nM | 469.91 | C[C@H](Nc1nc(N2C(=O)OC[C@@H]2[C@H](C)F)c2cc[nH]c2n1)c1cn(-c2ccc(Cl)cc2)cn1 | Homo sapiens | CHEMBL4309387 | single protein format | |
CHEMBL4439421 | IC50 | = | 2.0 | nM | 525.54 | Cc1cc([C@@H](C)Nc2nc(N3C(=O)OC[C@@H]3C(C)C)c3cc[nH]c3n2)ncc1-c1ccnc(C(F)(F)F)c1 | Homo sapiens | CHEMBL4309387 | single protein format | |
CHEMBL4529476 | IC50 | = | 2.1 | nM | 508.45 | C[C@H](Nc1ncc(F)c(N2C(=O)OC[C@@H]2[C@H](C)F)n1)c1ncn2c1CCc1cc(C(F)(F)F)ccc1-2 | Homo sapiens | CHEMBL4409429 | assay format | |
CHEMBL4548637 | IC50 | = | 2.12 | nM | 524.91 | C[C@H](Nc1nc(Cl)cc(N2C(=O)OC[C@@H]2[C@H](C)F)n1)c1ncn2c1CCc1cc(C(F)(F)F)ccc1-2 | Homo sapiens | CHEMBL4409429 | assay format | |
CHEMBL3980822 | IC50 | = | 3.0 | nM | 463.33 | C[C@H](Nc1nc(Cl)cc(N2C(=O)OCC2[C@@H](C)O)n1)c1cn(-c2ccc(Cl)cc2)cn1 | Homo sapiens | CHEMBL3889082 | single protein format | |
CHEMBL3979625 | IC50 | = | 3.0 | nM | 463.33 | C[C@H](Nc1nc(Cl)cc(N2C(=O)OC[C@@H]2[C@@H](C)O)n1)c1cn(-c2ccc(Cl)cc2)cn1 | Homo sapiens | CHEMBL3889082 | single protein format | |
CHEMBL4436236 | IC50 | = | 3.5 | nM | 506.48 | Cn1nccc1-c1cc2c(cc1F)Nc1ncc(F)cc1CN2C(=O)C1CCN(CC(F)(F)F)CC1 | Homo sapiens | CHEMBL4309354 | single protein format | |
CHEMBL4215717 | IC50 | = | 3.8 | nM | 501.56 | C[C@H](O)c1cccc(NC(=O)c2nn(Cc3ccc(F)cc3)c3c2CN(C(=O)c2ccc[nH]2)C[C@H]3C)c1 | Homo sapiens | CHEMBL4180903 | single protein format | |
CHEMBL3962229 | IC50 | = | 4.0 | nM | 480.38 | C[C@H](Nc1nc(Cl)cc(N2C(=O)OC[C@@H]2[C@@H](C)O)n1)c1cnc(-c2ccc(Cl)cc2)s1 | Homo sapiens | CHEMBL3889082 | single protein format | |
CHEMBL4170686 | IC50 | = | 4.0 | nM | 460.58 | CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2ccc(-c3ccnc(C(C)(C)C)c3)cn2)n1 | Homo sapiens | CHEMBL4135748 | single protein format | |
CHEMBL4526035 | IC50 | = | 4.0 | nM | 413.87 | COc1nc(N[C@@H](C)c2cc3cc(Cl)c(OC(C)C)cc3[nH]c2=O)ncc1C#N | Homo sapiens | CHEMBL4360242 | single protein format | |
CHEMBL5425749 | IC50 | = | 4.7 | nM | 532.64 | C=CS(=O)(=O)NC1CCN(c2ccc([C@H](C)Nc3ncc(F)c(N4C(=O)OC[C@@H]4C(C)C)n3)cc2)CC1 | Homo sapiens | CHEMBL5371973 | assay format | |
CHEMBL5093219 | IC50 | = | 4.9 | nM | 465.53 | CC(C)O[C@H]1CC[C@H](C(=O)N2Cc3cc(F)cnc3Nc3ccc(-c4cnn(C)c4)cc32)OC1 | Homo sapiens | CHEMBL5050624 | single protein format | |
CHEMBL3950128 | IC50 | = | 5.0 | nM | 547.94 | CC(O)[C@H]1COC(=O)N1c1nc(N[C@@H](C)C2CCN(c3ccc(Cl)c(OC(F)(F)F)c3)CC2)ncc1F | Homo sapiens | CHEMBL3889083 | single protein format |