Assay Detail
ADMET
CHEMBL945056
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Inhibition of CYP2C9
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Confidence | 8 — Homologous single protein target |
| Curated By | Intermediate |
Publication
High confidence predictions of drug-drug interactions: predicting affinities for cytochrome P450 2C9 with multiple computational methods.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 10 | 7.36 | 7.72 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL388590 | BENZBROMARONE | 4.0 | 1 | 7.72 |
| CHEMBL250251 | — | — | 1 | 7.00 |
| CHEMBL251070 | — | — | 1 | - |
| CHEMBL611490 | — | — | 1 | - |
| CHEMBL250080 | — | — | 1 | - |
| CHEMBL608833 | — | — | 1 | - |
| CHEMBL121626 | TOLFENAMIC ACID | 2.0 | 1 | - |
| CHEMBL608832 | — | — | 1 | - |
| CHEMBL23588 | FLUFENAMIC ACID | 2.0 | 1 | - |
| CHEMBL1162079 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL388590 | BENZBROMARONE | Ki | = | 19.0 | nM | 7.72 |
| CHEMBL250251 | — | Ki | = | 101.0 | nM | 7.00 |
| CHEMBL251070 | — | Ki | = | 50315292298.93 | nM | - |
| CHEMBL611490 | — | Ki | = | 136804379305693.1 | nM | - |
| CHEMBL250080 | — | Ki | = | 71121351365332.95 | nM | - |
| CHEMBL608833 | — | Ki | = | 689604362163702.8 | nM | - |
| CHEMBL121626 | TOLFENAMIC ACID | Ki | = | 537650433122253.3 | nM | - |
| CHEMBL608832 | — | Ki | = | 185182524363817.8 | nM | - |
| CHEMBL23588 | FLUFENAMIC ACID | Ki | = | 115904420522271.9 | nM | - |
| CHEMBL1162079 | — | Ki | = | 20835311605717.46 | nM | - |