Assay Detail
ADMET
CHEMBL1669909
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Inhibition of CYP3A4 after 30 mins by fluorometric assay
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Publication
Cytochrome P450 3A4 inhibitory constituents of the wood of Taxus yunnanensis.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 13 | 5.03 | 8.11 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL157101 | KETOCONAZOLE | 4.0 | 1 | 8.11 |
| CHEMBL463246 | ALPHA-CONIDENDRIN | — | 1 | 6.70 |
| CHEMBL518421 | LARICIRESINOL | — | 1 | 4.59 |
| CHEMBL368347 | (+)-SECOISOLARICIRESINOL | 2.0 | 1 | 4.33 |
| CHEMBL1668115 | — | — | 1 | 4.27 |
| CHEMBL1668112 | — | — | 1 | 4.18 |
| CHEMBL1668114 | TAXIRESINOL | — | 1 | 4.07 |
| CHEMBL1668108 | — | — | 1 | 4.00 |
| CHEMBL1668109 | — | — | 1 | - |
| CHEMBL1668110 | (7R)-7-HYDROXYTAXIRESINOL | — | 1 | - |
| CHEMBL1668111 | ISOTAXIRESINOL | — | 1 | - |
| CHEMBL1668113 | TANEGOOL | — | 1 | - |
| CHEMBL399512 | ISOLARICIRESINOL | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL157101 | KETOCONAZOLE | IC50 | = | 7.8 | nM | 8.11 |
| CHEMBL463246 | ALPHA-CONIDENDRIN | IC50 | = | 200.0 | nM | 6.70 |
| CHEMBL518421 | LARICIRESINOL | IC50 | = | 25600.0 | nM | 4.59 |
| CHEMBL368347 | (+)-SECOISOLARICIRESINOL | IC50 | = | 47300.0 | nM | 4.33 |
| CHEMBL1668115 | — | IC50 | = | 54200.0 | nM | 4.27 |
| CHEMBL1668112 | — | IC50 | = | 66500.0 | nM | 4.18 |
| CHEMBL1668114 | TAXIRESINOL | IC50 | = | 85600.0 | nM | 4.07 |
| CHEMBL1668108 | — | IC50 | = | 99500.0 | nM | 4.00 |
| CHEMBL1668109 | — | IC50 | - | — | - | |
| CHEMBL1668110 | (7R)-7-HYDROXYTAXIRESINOL | IC50 | - | — | - | |
| CHEMBL1668111 | ISOTAXIRESINOL | IC50 | - | — | - | |
| CHEMBL1668113 | TANEGOOL | IC50 | - | — | - | |
| CHEMBL399512 | ISOLARICIRESINOL | IC50 | > | 100000.0 | nM | - |