Assay Detail
Binding
CHEMBL981022
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Inhibition of HIV1 protease
29
Total Activities
23
Compounds Tested
3
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Human immunodeficiency virus 1 |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Harnessing nature's insight: design of aspartyl protease inhibitors from treatment of drug-resistant HIV to Alzheimer's disease.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 16 | 9.59 | 10.85 |
| IC50 | 12 | 8.37 | 10.30 |
| IC90 | 1 | - | - |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL178593 | — | — | 1 | 10.85 |
| CHEMBL469086 | — | — | 2 | 10.85 |
| CHEMBL1323 | DARUNAVIR | 4.0 | 1 | 10.85 |
| CHEMBL461482 | — | — | 1 | 10.80 |
| CHEMBL492254 | — | — | 2 | 10.59 |
| CHEMBL451129 | — | — | 1 | 10.30 |
| CHEMBL509137 | — | — | 2 | 9.96 |
| CHEMBL510370 | — | — | 2 | 9.80 |
| CHEMBL101560 | — | — | 1 | 9.52 |
| CHEMBL114 | SAQUINAVIR | 4.0 | 1 | 8.85 |
| CHEMBL161005 | — | — | 1 | 8.85 |
| CHEMBL482842 | — | — | 1 | 8.85 |
| CHEMBL315403 | — | — | 1 | 8.74 |
| CHEMBL254349 | — | — | 2 | 8.74 |
| CHEMBL499476 | — | — | 1 | 8.66 |
| CHEMBL486890 | — | — | 1 | 8.54 |
| CHEMBL474881 | — | — | 1 | 8.43 |
| CHEMBL486891 | — | — | 1 | 8.41 |
| CHEMBL113090 | — | — | 1 | 7.77 |
| CHEMBL273317 | — | — | 1 | 7.12 |
| CHEMBL18389 | — | — | 1 | 6.80 |
| CHEMBL116 | AMPRENAVIR | 4.0 | 2 | - |
| CHEMBL319408 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1323 | DARUNAVIR | Ki | = | 0.014 | nM | 10.85 |
| CHEMBL178593 | — | Ki | = | 0.014 | nM | 10.85 |
| CHEMBL469086 | — | Ki | = | 0.014 | nM | 10.85 |
| CHEMBL461482 | — | Ki | = | 0.016 | nM | 10.80 |
| CHEMBL492254 | — | Ki | = | 0.026 | nM | 10.59 |
| CHEMBL451129 | — | IC50 | = | 0.05 | nM | 10.30 |
| CHEMBL509137 | — | Ki | = | 0.11 | nM | 9.96 |
| CHEMBL510370 | — | Ki | = | 0.16 | nM | 9.80 |
| CHEMBL101560 | — | IC50 | = | 0.3 | nM | 9.52 |
| CHEMBL161005 | — | Ki | = | 1.4 | nM | 8.85 |
| CHEMBL469086 | — | IC50 | = | 1.4 | nM | 8.85 |
| CHEMBL114 | SAQUINAVIR | Ki | = | 1.4 | nM | 8.85 |
| CHEMBL482842 | — | Ki | = | 1.4 | nM | 8.85 |
| CHEMBL254349 | — | IC50 | = | 1.8 | nM | 8.74 |
| CHEMBL315403 | — | IC50 | = | 1.8 | nM | 8.74 |
| CHEMBL499476 | — | Ki | = | 2.2 | nM | 8.66 |
| CHEMBL486890 | — | Ki | = | 2.9 | nM | 8.54 |
| CHEMBL474881 | — | Ki | = | 3.7 | nM | 8.43 |
| CHEMBL509137 | — | IC50 | = | 3.8 | nM | 8.42 |
| CHEMBL486891 | — | Ki | = | 3.9 | nM | 8.41 |
| CHEMBL492254 | — | IC50 | = | 5.0 | nM | 8.30 |
| CHEMBL113090 | — | IC50 | = | 17.0 | nM | 7.77 |
| CHEMBL510370 | — | IC50 | = | 28.0 | nM | 7.55 |
| CHEMBL273317 | — | IC50 | = | 76.0 | nM | 7.12 |
| CHEMBL18389 | — | IC50 | = | 160.0 | nM | 6.80 |
| CHEMBL254349 | — | Ki | = | 0.0045 | nM | - |
| CHEMBL116 | AMPRENAVIR | IC90 | = | 40.0 | nM | - |
| CHEMBL319408 | — | IC50 | < | 0.03 | nM | - |
| CHEMBL116 | AMPRENAVIR | Ki | = | 0.6 | nM | - |