Assay Detail
Binding
CHEMBL5112019
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Binding affinity to A1R S267 7.32A mutant (unknown origin) in by saturation NanoBRET binding assay
3
Total Activities
3
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Dual A1/A3 Adenosine Receptor Antagonists: Binding Kinetics and Structure-Activity Relationship Studies Using Mutagenesis and Alchemical Binding Free Energy Calculations.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Kd | 3 | 7.19 | 8.10 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL5181728 | — | — | 1 | 8.10 |
| CHEMBL5187736 | — | — | 1 | 7.15 |
| CHEMBL464859 | NECA | — | 1 | 6.31 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL5181728 | — | Kd | = | 7.943 | nM | 8.10 |
| CHEMBL5187736 | — | Kd | = | 70.99 | nM | 7.15 |
| CHEMBL464859 | NECA | Kd | = | 489.78 | nM | 6.31 |