Assay Detail
Functional
CHEMBL804179
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Effective concentration against HIV-1 reverse transcriptase
8
Total Activities
8
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Functional |
| Confidence | 8 — Homologous single protein target |
| Curated By | Autocuration |
Target
Human immunodeficiency virus type 1 reverse transcriptase (CHEMBL247) ↗| Type | SINGLE PROTEIN |
| Organism | Human immunodeficiency virus 1 |
Publication
Prediction of the binding free energies of new TIBO-like HIV-1 reverse transcriptase inhibitors using a combination of PROFEC, PB/SA, CMC/MD, and free energy calculations.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| EC50 | 8 | 7.28 | 8.34 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL172454 | — | — | 1 | 8.34 |
| CHEMBL58711 | TIVIRAPINE | 2.0 | 1 | 8.29 |
| CHEMBL353467 | — | — | 1 | 7.85 |
| CHEMBL293498 | — | — | 1 | 7.48 |
| CHEMBL170682 | — | — | 1 | 7.41 |
| CHEMBL46961 | — | — | 1 | 7.36 |
| CHEMBL168177 | — | — | 1 | 6.10 |
| CHEMBL353986 | — | — | 1 | 5.38 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL172454 | — | EC50 | = | 4.6 | nM | 8.34 |
| CHEMBL58711 | TIVIRAPINE | EC50 | = | 5.1 | nM | 8.29 |
| CHEMBL353467 | — | EC50 | = | 14.0 | nM | 7.85 |
| CHEMBL293498 | — | EC50 | = | 33.0 | nM | 7.48 |
| CHEMBL170682 | — | EC50 | = | 39.0 | nM | 7.41 |
| CHEMBL46961 | — | EC50 | = | 44.0 | nM | 7.36 |
| CHEMBL168177 | — | EC50 | = | 790.0 | nM | 6.10 |
| CHEMBL353986 | — | EC50 | = | 4200.0 | nM | 5.38 |