Assay Detail
ADMET
CHEMBL1008932
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of CYP3A4
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Confidence | 8 — Homologous single protein target |
| Curated By | Intermediate |
Publication
Discovery of sodium R-(+)-4-{2-[5-(2-fluoro-3-methoxyphenyl)-3-(2-fluoro-6-[trifluoromethyl]benzyl)-4-methyl-2,6-dioxo-3,6-dihydro-2H-pyrimidin-1-yl]-1-phenylethylamino}butyrate (elagolix), a potent and orally available nonpeptide antagonist of the human gonadotropin-releasing hormone receptor.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 12 | 5.19 | 7.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL434936 | — | — | 1 | 7.00 |
| CHEMBL468551 | — | — | 1 | 6.64 |
| CHEMBL510285 | — | — | 1 | 6.36 |
| CHEMBL179691 | — | — | 1 | 6.16 |
| CHEMBL502341 | — | — | 1 | 4.96 |
| CHEMBL510538 | — | — | 1 | 4.54 |
| CHEMBL509075 | — | — | 1 | 4.44 |
| CHEMBL509440 | — | — | 1 | 4.44 |
| CHEMBL502182 | ELAGOLIX SODIUM | 4.0 | 1 | 4.25 |
| CHEMBL503705 | — | — | 1 | 4.16 |
| CHEMBL501329 | — | — | 1 | 4.16 |
| CHEMBL506877 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL434936 | — | IC50 | = | 100.0 | nM | 7.00 |
| CHEMBL468551 | — | IC50 | = | 230.0 | nM | 6.64 |
| CHEMBL510285 | — | IC50 | = | 440.0 | nM | 6.36 |
| CHEMBL179691 | — | IC50 | = | 700.0 | nM | 6.16 |
| CHEMBL502341 | — | IC50 | = | 11000.0 | nM | 4.96 |
| CHEMBL510538 | — | IC50 | = | 29000.0 | nM | 4.54 |
| CHEMBL509075 | — | IC50 | = | 36000.0 | nM | 4.44 |
| CHEMBL509440 | — | IC50 | = | 36000.0 | nM | 4.44 |
| CHEMBL502182 | ELAGOLIX SODIUM | IC50 | = | 56000.0 | nM | 4.25 |
| CHEMBL503705 | — | IC50 | = | 69000.0 | nM | 4.16 |
| CHEMBL501329 | — | IC50 | = | 69000.0 | nM | 4.16 |
| CHEMBL506877 | — | IC50 | = | 135000.0 | nM | - |