Assay Detail
Binding
CHEMBL804264
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Inhibition of HIV-1 reverse transcriptase at 37 degree Centigrade
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Confidence | 8 — Homologous single protein target |
| Curated By | Expert |
Target
Human immunodeficiency virus type 1 reverse transcriptase (CHEMBL247) ↗| Type | SINGLE PROTEIN |
| Organism | Human immunodeficiency virus 1 |
Publication
Estimation of binding affinities for HEPT and nevirapine analogues with HIV-1 reverse transcriptase via Monte Carlo simulations.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| EC50 | 20 | 6.72 | 8.57 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL39015 | — | — | 1 | 8.57 |
| CHEMBL276108 | — | — | 1 | 8.57 |
| CHEMBL35033 | EMIVIRINE | 2.0 | 1 | 8.40 |
| CHEMBL288688 | — | — | 1 | 8.23 |
| CHEMBL38711 | — | — | 1 | 7.92 |
| CHEMBL16684 | — | — | 1 | 7.89 |
| CHEMBL36995 | — | — | 1 | 7.72 |
| CHEMBL37067 | — | — | 1 | 7.06 |
| CHEMBL39093 | — | — | 1 | 7.00 |
| CHEMBL275599 | — | — | 1 | 6.58 |
| CHEMBL37743 | — | — | 1 | 6.48 |
| CHEMBL288728 | — | — | 1 | 5.92 |
| CHEMBL39047 | — | — | 1 | 5.68 |
| CHEMBL38768 | — | — | 1 | 5.66 |
| CHEMBL40091 | — | — | 1 | 5.44 |
| CHEMBL31871 | HEPT | — | 1 | 5.16 |
| CHEMBL36427 | — | — | 1 | 4.64 |
| CHEMBL286769 | — | — | 1 | 4.07 |
| CHEMBL290413 | — | — | 1 | - |
| CHEMBL290685 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL39015 | — | EC50 | = | 2.7 | nM | 8.57 |
| CHEMBL276108 | — | EC50 | = | 2.7 | nM | 8.57 |
| CHEMBL35033 | EMIVIRINE | EC50 | = | 4.0 | nM | 8.40 |
| CHEMBL288688 | — | EC50 | = | 5.9 | nM | 8.23 |
| CHEMBL38711 | — | EC50 | = | 12.0 | nM | 7.92 |
| CHEMBL16684 | — | EC50 | = | 13.0 | nM | 7.89 |
| CHEMBL36995 | — | EC50 | = | 19.0 | nM | 7.72 |
| CHEMBL37067 | — | EC50 | = | 88.0 | nM | 7.06 |
| CHEMBL39093 | — | EC50 | = | 100.0 | nM | 7.00 |
| CHEMBL275599 | — | EC50 | = | 260.0 | nM | 6.58 |
| CHEMBL37743 | — | EC50 | = | 330.0 | nM | 6.48 |
| CHEMBL288728 | — | EC50 | = | 1200.0 | nM | 5.92 |
| CHEMBL39047 | — | EC50 | = | 2100.0 | nM | 5.68 |
| CHEMBL38768 | — | EC50 | = | 2200.0 | nM | 5.66 |
| CHEMBL40091 | — | EC50 | = | 3600.0 | nM | 5.44 |
| CHEMBL31871 | HEPT | EC50 | = | 7000.0 | nM | 5.16 |
| CHEMBL36427 | — | EC50 | = | 23000.0 | nM | 4.64 |
| CHEMBL286769 | — | EC50 | = | 85000.0 | nM | 4.07 |
| CHEMBL290413 | — | EC50 | > | 250000.0 | nM | - |
| CHEMBL290685 | — | EC50 | > | 150000.0 | nM | - |