Assay Detail
Functional
CHEMBL687028
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Potency evaluated against NNRTI-Resistant HIV-1 strain Tyr181Cys
11
Total Activities
11
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Functional |
| Organism | Human immunodeficiency virus 1 |
| Confidence | 1 — Organism |
| Curated By | Intermediate |
Target
Human immunodeficiency virus 1 (CHEMBL378) ↗| Type | ORGANISM |
| Organism | Human immunodeficiency virus 1 |
Publication
Roles of conformational and positional adaptability in structure-based design of TMC125-R165335 (etravirine) and related non-nucleoside reverse transcriptase inhibitors that are highly potent and effective against wild-type and drug-resistant HIV-1 variants.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| EC50 | 11 | 6.84 | 8.70 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL223228 | EFAVIRENZ | 4.0 | 1 | 8.70 |
| CHEMBL87647 | — | — | 1 | 8.22 |
| CHEMBL308954 | ETRAVIRINE | 4.0 | 1 | 8.22 |
| CHEMBL70663 | DAPIVIRINE | 3.0 | 1 | 8.10 |
| CHEMBL313405 | — | — | 1 | 6.60 |
| CHEMBL70967 | — | — | 1 | 6.60 |
| CHEMBL307297 | — | — | 1 | 6.56 |
| CHEMBL303457 | — | — | 1 | 6.29 |
| CHEMBL593 | DELAVIRDINE | 4.0 | 1 | 5.87 |
| CHEMBL57 | NEVIRAPINE | 4.0 | 1 | 5.27 |
| CHEMBL314060 | (R)-LOVIRIDE | — | 1 | 4.80 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL223228 | EFAVIRENZ | EC50 | = | 2.0 | nM | 8.70 |
| CHEMBL87647 | — | EC50 | = | 6.0 | nM | 8.22 |
| CHEMBL308954 | ETRAVIRINE | EC50 | = | 6.0 | nM | 8.22 |
| CHEMBL70663 | DAPIVIRINE | EC50 | = | 8.0 | nM | 8.10 |
| CHEMBL313405 | — | EC50 | = | 250.0 | nM | 6.60 |
| CHEMBL70967 | — | EC50 | = | 250.0 | nM | 6.60 |
| CHEMBL307297 | — | EC50 | = | 277.0 | nM | 6.56 |
| CHEMBL303457 | — | EC50 | = | 511.0 | nM | 6.29 |
| CHEMBL593 | DELAVIRDINE | EC50 | = | 1336.0 | nM | 5.87 |
| CHEMBL57 | NEVIRAPINE | EC50 | = | 5351.0 | nM | 5.27 |
| CHEMBL314060 | (R)-LOVIRIDE | EC50 | = | 15800.0 | nM | 4.80 |