Q9UNU6 | CP8B1_HUMAN | 7-alpha-hydroxycholest-4-en-3-one 12-alpha-hydroxylase (CYP8B1)
Pfam Domain Table
| Accession | Domain | Range | Color |
|---|---|---|---|
| PF00067 | p450 - Cytochrome P450 | 37~491 |
3D structures mapped by conservation among orthologs
[ Alpha Fold Model ] (go)
Known binders annotated in ChEMBL
Only the first 20 rows are shown.
| molecule_chembl_id | structure | assay_type | relation | value | unit | mol_wt | smiles | organism | assay_chembl_id | bao_label |
|---|---|---|---|---|---|---|---|---|---|---|
| CHEMBL4436614 |  |
IC50 | = | 0.17 | nM | 526.49 | Cc1cnc2cc(C(F)(F)F)ccc2c1N1CC[C@H](C(=O)N2CCn3c(nnc3C(F)(F)F)C2)[C@H](C)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4455566 |  |
IC50 | = | 0.2 | nM | 546.9 | C[C@@H]1CN(c2c(Cl)cnc3cc(C(F)(F)F)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4469186 |  |
IC50 | = | 0.2 | nM | 545.95 | C[C@@H]1CN(c2c(Cl)cnc3cc(-c4ncco4)ccc23)CC[C@@H]1C(=O)N1CCc2c(noc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4453090 |  |
IC50 | = | 0.2 | nM | 508.93 | COc1ccc2c(N3CC[C@H](C(=O)N4CCn5c(nnc5C(F)(F)F)C4)[C@H](C)C3)c(Cl)cnc2c1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4566069 |  |
IC50 | = | 0.2 | nM | 519.48 | COc1ccc2c(N3CC[C@H](C(=O)N4CCn5c(nnc5C(F)(F)F)C4)[C@H](C)C3)c([N+](=O)[O-])cnc2c1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4445397 |  |
IC50 | = | 0.22 | nM | 549.0 | C[C@@H]1CN(c2c(Cl)cnc3cc(OCC4CC4)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4580955 |  |
IC50 | = | 0.25 | nM | 530.45 | C[C@@H]1CN(c2c(F)cnc3cc(C(F)(F)F)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4459136 |  |
IC50 | = | 0.25 | nM | 518.97 | C[C@@H]1CN(c2c(Cl)cnc3cc(C4CC4)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4452352 |  |
IC50 | = | 0.28 | nM | 520.94 | CC(=O)c1ccc2c(N3CC[C@H](C(=O)N4CCn5c(nnc5C(F)(F)F)C4)[C@H](C)C3)c(Cl)cnc2c1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4450590 |  |
IC50 | = | 0.31 | nM | 522.52 | Cc1cnc2cc(C(C)(F)F)ccc2c1N1CC[C@H](C(=O)N2CCn3c(nnc3C(F)(F)F)C2)[C@H](C)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4588702 |  |
IC50 | = | 0.32 | nM | 528.91 | C[C@@H]1CN(c2c(Cl)cnc3cc(C(F)F)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4435552 |  |
IC50 | = | 0.34 | nM | 528.46 | C[C@@H]1CN(c2ccnc3cc(OC(F)(F)F)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4440278 |  |
IC50 | = | 0.35 | nM | 562.9 | C[C@@H]1CN(c2c(Cl)cnc3cc(OC(F)(F)F)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4515054 |  |
IC50 | = | 0.38 | nM | 526.92 | COc1ccc2c(N3CC[C@H](C(=O)N4CCn5c(nnc5C(F)(F)F)C4)[C@H](C)C3)c(Cl)cnc2c1F | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4565048 |  |
IC50 | = | 0.4 | nM | 511.51 | C[C@@H]1CN(c2ccnc3cc(-c4ncco4)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4462103 |  |
IC50 | = | 0.4 | nM | 561.01 | C[C@@H]1CN(c2c(Cl)cnc3c2CCN(c2ccccn2)C3)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4576569 |  |
IC50 | = | 0.4 | nM | 520.56 | C[C@@H]1CN(c2ccnc3cc(-c4ccccc4)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4568439 |  |
IC50 | = | 0.44 | nM | 557.8 | C[C@@H]1CN(c2c(Cl)cnc3cc(Br)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4517730 |  |
IC50 | = | 0.46 | nM | 512.46 | C[C@@H]1CN(c2c(F)cnc3cc(C(F)F)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |
| CHEMBL4461071 |  |
IC50 | = | 0.46 | nM | 542.94 | C[C@@H]1CN(c2c(Cl)cnc3cc(C(C)(F)F)ccc23)CC[C@@H]1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 | Homo sapiens | CHEMBL4418456 | microsome format |