Assay Detail
Binding
CHEMBL4195354
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Inhibition of wild type HIV-1 NL4-3 protease expressed in Escherichia coli Rosetta (DE3)pLysS using Ac-Thr-Ile-Nle-Nle-Gln-Arg-NH2 as substrate by fluorescence assay
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Human immunodeficiency virus 1 |
| Confidence | 9 — Direct single protein target |
| Curated By | Intermediate |
Publication
Design and Synthesis of Highly Potent HIV-1 Protease Inhibitors Containing Tricyclic Fused Ring Systems as Novel P2 Ligands: Structure-Activity Studies, Biological and X-ray Structural Analysis.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 13 | 10.07 | 11.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4211505 | — | — | 1 | 11.00 |
| CHEMBL4207145 | — | — | 1 | 10.92 |
| CHEMBL1323 | DARUNAVIR | 4.0 | 1 | 10.80 |
| CHEMBL4205056 | — | — | 1 | 10.35 |
| CHEMBL4217920 | — | — | 1 | 10.30 |
| CHEMBL4210992 | — | — | 1 | 10.30 |
| CHEMBL4214741 | — | — | 1 | 10.05 |
| CHEMBL4215950 | — | — | 1 | 9.35 |
| CHEMBL4218875 | — | — | 1 | 9.30 |
| CHEMBL4206617 | — | — | 1 | 8.34 |
| CHEMBL4218164 | — | — | 1 | - |
| CHEMBL4213229 | — | — | 1 | - |
| CHEMBL4214453 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4211505 | — | Ki | = | 0.01 | nM | 11.00 |
| CHEMBL4207145 | — | Ki | = | 0.012 | nM | 10.92 |
| CHEMBL1323 | DARUNAVIR | Ki | = | 0.016 | nM | 10.80 |
| CHEMBL4205056 | — | Ki | = | 0.045 | nM | 10.35 |
| CHEMBL4217920 | — | Ki | = | 0.05 | nM | 10.30 |
| CHEMBL4210992 | — | Ki | = | 0.05 | nM | 10.30 |
| CHEMBL4214741 | — | Ki | = | 0.09 | nM | 10.05 |
| CHEMBL4215950 | — | Ki | = | 0.45 | nM | 9.35 |
| CHEMBL4218875 | — | Ki | = | 0.5 | nM | 9.30 |
| CHEMBL4206617 | — | Ki | = | 4.55 | nM | 8.34 |
| CHEMBL4218164 | — | Ki | = | 0.008 | nM | - |
| CHEMBL4213229 | — | Ki | = | 0.005 | nM | - |
| CHEMBL4214453 | — | Ki | = | 0.002 | nM | - |