Assay Detail
ADMET
CHEMBL972103
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Binding affinity to CYP2C9
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 | Intermediate |
Publication
Modeling and synthesis of novel tight-binding inhibitors of cytochrome P450 2C9.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 13 | 6.46 | 8.38 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL456432 | — | — | 1 | 8.38 |
| CHEMBL388590 | BENZBROMARONE | 4.0 | 1 | 7.72 |
| CHEMBL458566 | — | — | 1 | 7.64 |
| CHEMBL458567 | — | — | 1 | 7.39 |
| CHEMBL457087 | — | — | 1 | 7.35 |
| CHEMBL250251 | — | — | 1 | 7.00 |
| CHEMBL465715 | — | — | 1 | 6.18 |
| CHEMBL465664 | — | — | 1 | 5.85 |
| CHEMBL459249 | — | — | 1 | 5.51 |
| CHEMBL464669 | — | — | 1 | 5.31 |
| CHEMBL465716 | — | — | 1 | 5.23 |
| CHEMBL465908 | — | — | 1 | 5.19 |
| CHEMBL445600 | — | — | 1 | 5.17 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL456432 | — | Ki | = | 4.2 | nM | 8.38 |
| CHEMBL388590 | BENZBROMARONE | Ki | = | 19.0 | nM | 7.72 |
| CHEMBL458566 | — | Ki | = | 23.0 | nM | 7.64 |
| CHEMBL458567 | — | Ki | = | 41.0 | nM | 7.39 |
| CHEMBL457087 | — | Ki | = | 44.34 | nM | 7.35 |
| CHEMBL250251 | — | Ki | = | 101.0 | nM | 7.00 |
| CHEMBL465715 | — | Ki | = | 656.0 | nM | 6.18 |
| CHEMBL465664 | — | Ki | = | 1420.0 | nM | 5.85 |
| CHEMBL459249 | — | Ki | = | 3120.0 | nM | 5.51 |
| CHEMBL464669 | — | Ki | = | 4870.0 | nM | 5.31 |
| CHEMBL465716 | — | Ki | = | 5930.0 | nM | 5.23 |
| CHEMBL465908 | — | Ki | = | 6480.0 | nM | 5.19 |
| CHEMBL445600 | — | Ki | = | 6740.0 | nM | 5.17 |