Assay Detail
Binding
CHEMBL751823
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Inhibitory concentration against hepatitis C virus NS3 protease
25
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Hepacivirus hominis |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Structure-activity study on a novel series of macrocyclic inhibitors of the hepatitis C virus NS3 protease leading to the discovery of BILN 2061.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 25 | 8.28 | 9.30 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL216120 | — | — | 1 | 9.30 |
| CHEMBL39112 | — | — | 1 | 8.85 |
| CHEMBL430940 | — | — | 1 | 8.66 |
| CHEMBL43030 | — | — | 1 | 8.66 |
| CHEMBL39000 | — | — | 1 | 8.60 |
| CHEMBL288533 | — | — | 1 | 8.60 |
| CHEMBL40490 | — | — | 1 | 8.55 |
| CHEMBL290512 | — | — | 1 | 8.54 |
| CHEMBL297884 | CILUPREVIR | 2.0 | 1 | 8.52 |
| CHEMBL40265 | — | — | 1 | 8.52 |
| CHEMBL289765 | — | — | 1 | 8.46 |
| CHEMBL288155 | — | — | 1 | 8.44 |
| CHEMBL288413 | — | — | 1 | 8.33 |
| CHEMBL291040 | — | — | 1 | 8.32 |
| CHEMBL288627 | — | — | 1 | 8.29 |
| CHEMBL287792 | — | — | 1 | 8.26 |
| CHEMBL41661 | — | — | 1 | 8.26 |
| CHEMBL431911 | — | — | 1 | 8.19 |
| CHEMBL295844 | — | — | 1 | 7.96 |
| CHEMBL41182 | — | — | 1 | 7.92 |
| CHEMBL290515 | — | — | 1 | 7.89 |
| CHEMBL431312 | — | — | 1 | 7.85 |
| CHEMBL291153 | — | — | 1 | 7.66 |
| CHEMBL289593 | — | — | 1 | 7.62 |
| CHEMBL44180 | — | — | 1 | 6.77 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL216120 | — | IC50 | = | 0.5 | nM | 9.30 |
| CHEMBL39112 | — | IC50 | = | 1.4 | nM | 8.85 |
| CHEMBL430940 | — | IC50 | = | 2.2 | nM | 8.66 |
| CHEMBL43030 | — | IC50 | = | 2.2 | nM | 8.66 |
| CHEMBL39000 | — | IC50 | = | 2.5 | nM | 8.60 |
| CHEMBL288533 | — | IC50 | = | 2.5 | nM | 8.60 |
| CHEMBL40490 | — | IC50 | = | 2.8 | nM | 8.55 |
| CHEMBL290512 | — | IC50 | = | 2.9 | nM | 8.54 |
| CHEMBL297884 | CILUPREVIR | IC50 | = | 3.0 | nM | 8.52 |
| CHEMBL40265 | — | IC50 | = | 3.0 | nM | 8.52 |
| CHEMBL289765 | — | IC50 | = | 3.5 | nM | 8.46 |
| CHEMBL288155 | — | IC50 | = | 3.6 | nM | 8.44 |
| CHEMBL288413 | — | IC50 | = | 4.7 | nM | 8.33 |
| CHEMBL291040 | — | IC50 | = | 4.8 | nM | 8.32 |
| CHEMBL288627 | — | IC50 | = | 5.1 | nM | 8.29 |
| CHEMBL287792 | — | IC50 | = | 5.5 | nM | 8.26 |
| CHEMBL41661 | — | IC50 | = | 5.5 | nM | 8.26 |
| CHEMBL431911 | — | IC50 | = | 6.4 | nM | 8.19 |
| CHEMBL295844 | — | IC50 | = | 11.0 | nM | 7.96 |
| CHEMBL41182 | — | IC50 | = | 12.0 | nM | 7.92 |
| CHEMBL290515 | — | IC50 | = | 13.0 | nM | 7.89 |
| CHEMBL431312 | — | IC50 | = | 14.0 | nM | 7.85 |
| CHEMBL291153 | — | IC50 | = | 22.0 | nM | 7.66 |
| CHEMBL289593 | — | IC50 | = | 24.0 | nM | 7.62 |
| CHEMBL44180 | — | IC50 | = | 170.0 | nM | 6.77 |