Assay Detail
ADMET
CHEMBL4182854
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Transactivation of PXR in human HepG2 cells by receptor transactivation assay
29
Total Activities
26
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Cell Type | HepG2 |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Target
Nuclear receptor subfamily 1 group I member 2 (CHEMBL3401) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Identification of bicyclic hexafluoroisopropyl alcohol sulfonamides as retinoic acid receptor-related orphan receptor gamma (RORγ/RORc) inverse agonists. Employing structure-based drug design to improve pregnane X receptor (PXR) selectivity.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| EC50 | 29 | 6.66 | 8.10 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL62136 | T091317 | — | 1 | 8.10 |
| CHEMBL4209665 | — | — | 1 | 7.80 |
| CHEMBL4217418 | — | — | 1 | 7.75 |
| CHEMBL4210791 | — | — | 1 | 7.70 |
| CHEMBL4212458 | — | — | 1 | 7.60 |
| CHEMBL4206412 | — | — | 1 | 7.44 |
| CHEMBL4217890 | — | — | 1 | 7.26 |
| CHEMBL4214210 | — | — | 1 | 6.84 |
| CHEMBL4214711 | — | — | 1 | 6.76 |
| CHEMBL4213493 | — | — | 1 | 6.72 |
| CHEMBL4213534 | — | — | 1 | 6.64 |
| CHEMBL4216643 | — | — | 1 | 6.60 |
| CHEMBL4209091 | — | — | 1 | 6.59 |
| CHEMBL4211051 | — | — | 2 | 6.57 |
| CHEMBL4205428 | — | — | 1 | 6.42 |
| CHEMBL4218626 | — | — | 1 | 6.28 |
| CHEMBL4206368 | — | — | 3 | 5.96 |
| CHEMBL4215334 | — | — | 1 | 5.74 |
| CHEMBL4214055 | — | — | 1 | 5.70 |
| CHEMBL4212978 | — | — | 1 | 5.70 |
| CHEMBL4204747 | — | — | 1 | 5.54 |
| CHEMBL4209808 | — | — | 1 | - |
| CHEMBL4214020 | — | — | 1 | - |
| CHEMBL4218423 | — | — | 1 | - |
| CHEMBL4208087 | — | — | 1 | - |
| CHEMBL4212995 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL62136 | T091317 | EC50 | = | 8.0 | nM | 8.10 |
| CHEMBL4209665 | — | EC50 | = | 16.0 | nM | 7.80 |
| CHEMBL4217418 | — | EC50 | = | 18.0 | nM | 7.75 |
| CHEMBL4210791 | — | EC50 | = | 20.0 | nM | 7.70 |
| CHEMBL4212458 | — | EC50 | = | 25.0 | nM | 7.60 |
| CHEMBL4206412 | — | EC50 | = | 36.0 | nM | 7.44 |
| CHEMBL4217890 | — | EC50 | = | 55.0 | nM | 7.26 |
| CHEMBL4214210 | — | EC50 | = | 144.0 | nM | 6.84 |
| CHEMBL4214711 | — | EC50 | = | 175.0 | nM | 6.76 |
| CHEMBL4213493 | — | EC50 | = | 190.0 | nM | 6.72 |
| CHEMBL4213534 | — | EC50 | = | 228.0 | nM | 6.64 |
| CHEMBL4216643 | — | EC50 | = | 250.0 | nM | 6.60 |
| CHEMBL4209091 | — | EC50 | = | 254.0 | nM | 6.59 |
| CHEMBL4211051 | — | EC50 | = | 270.0 | nM | 6.57 |
| CHEMBL4211051 | — | EC50 | = | 300.0 | nM | 6.52 |
| CHEMBL4205428 | — | EC50 | = | 380.0 | nM | 6.42 |
| CHEMBL4218626 | — | EC50 | = | 520.0 | nM | 6.28 |
| CHEMBL4206368 | — | EC50 | = | 1100.0 | nM | 5.96 |
| CHEMBL4206368 | — | EC50 | = | 1350.0 | nM | 5.87 |
| CHEMBL4206368 | — | EC50 | = | 1510.0 | nM | 5.82 |
| CHEMBL4215334 | — | EC50 | = | 1830.0 | nM | 5.74 |
| CHEMBL4214055 | — | EC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL4212978 | — | EC50 | = | 2000.0 | nM | 5.70 |
| CHEMBL4204747 | — | EC50 | = | 2860.0 | nM | 5.54 |
| CHEMBL4218423 | — | EC50 | - | — | - | |
| CHEMBL4208087 | — | EC50 | - | — | - | |
| CHEMBL4212995 | — | EC50 | - | — | - | |
| CHEMBL4209808 | — | EC50 | - | — | - | |
| CHEMBL4214020 | — | EC50 | - | — | - |