Assay Detail
Binding
CHEMBL4404615
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Allosteric inhibition of [3H]-2-tert-butoxy-2-[2-methyl-4-(p-tolyl)-3-quinolyl]acetic acid binding to HIV1 integrase measured after 1 hr under dark condition by microbeta plate reader method
18
Total Activities
17
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 | Autocuration |
Target
Human immunodeficiency virus type 1 integrase (CHEMBL3471) ↗| Type | SINGLE PROTEIN |
| Organism | Human immunodeficiency virus 1 |
Publication
Discovery and Optimization of Novel Pyrazolopyrimidines as Potent and Orally Bioavailable Allosteric HIV-1 Integrase Inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 18 | 5.99 | 7.40 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4476366 | — | — | 1 | 7.40 |
| CHEMBL4460705 | — | — | 1 | 7.22 |
| CHEMBL4454255 | — | — | 1 | 7.05 |
| CHEMBL4573064 | — | — | 2 | 6.77 |
| CHEMBL4565963 | — | — | 1 | 6.51 |
| CHEMBL4538853 | — | — | 1 | 6.37 |
| CHEMBL4461955 | — | — | 1 | 6.17 |
| CHEMBL4469948 | — | — | 1 | 5.70 |
| CHEMBL4541973 | — | — | 1 | 5.47 |
| CHEMBL4452801 | — | — | 1 | 5.43 |
| CHEMBL4475105 | — | — | 1 | 5.36 |
| CHEMBL4587557 | — | — | 1 | 4.82 |
| CHEMBL4560817 | — | — | 1 | 4.17 |
| CHEMBL4440179 | — | — | 1 | - |
| CHEMBL4592796 | — | — | 1 | - |
| CHEMBL4551451 | — | — | 1 | - |
| CHEMBL4439901 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4476366 | — | Ki | = | 40.0 | nM | 7.40 |
| CHEMBL4460705 | — | Ki | = | 60.0 | nM | 7.22 |
| CHEMBL4454255 | — | Ki | = | 90.0 | nM | 7.05 |
| CHEMBL4573064 | — | Ki | = | 170.0 | nM | 6.77 |
| CHEMBL4565963 | — | Ki | = | 310.0 | nM | 6.51 |
| CHEMBL4538853 | — | Ki | = | 430.0 | nM | 6.37 |
| CHEMBL4461955 | — | Ki | = | 680.0 | nM | 6.17 |
| CHEMBL4469948 | — | Ki | = | 2000.0 | nM | 5.70 |
| CHEMBL4541973 | — | Ki | = | 3400.0 | nM | 5.47 |
| CHEMBL4573064 | — | Ki | = | 3400.0 | nM | 5.47 |
| CHEMBL4452801 | — | Ki | = | 3700.0 | nM | 5.43 |
| CHEMBL4475105 | — | Ki | = | 4400.0 | nM | 5.36 |
| CHEMBL4587557 | — | Ki | = | 15300.0 | nM | 4.82 |
| CHEMBL4560817 | — | Ki | = | 67000.0 | nM | 4.17 |
| CHEMBL4440179 | — | Ki | > | 40000.0 | nM | - |
| CHEMBL4592796 | — | Ki | > | 40000.0 | nM | - |
| CHEMBL4551451 | — | Ki | > | 40000.0 | nM | - |
| CHEMBL4439901 | — | Ki | > | 53000.0 | nM | - |