Assay Detail
Functional
CHEMBL884760
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Antagonist activity against human Adenosine A2b receptor
7
Total Activities
7
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Functional |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Expert |
Publication
Molecular modeling and molecular dynamics simulation of the human A2B adenosine receptor. The study of the possible binding modes of the A2B receptor antagonists.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 7 | 7.48 | 8.32 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL199249 | — | — | 1 | 8.32 |
| CHEMBL199196 | — | — | 1 | 8.31 |
| CHEMBL260331 | — | — | 1 | 8.26 |
| CHEMBL32598 | — | — | 1 | 8.05 |
| CHEMBL198326 | — | — | 1 | 7.75 |
| CHEMBL418333 | — | — | 1 | 6.60 |
| CHEMBL1355736 | THEOPHYLLINE | 4.0 | 1 | 5.04 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL199249 | — | Ki | = | 4.8 | nM | 8.32 |
| CHEMBL199196 | — | Ki | = | 4.9 | nM | 8.31 |
| CHEMBL260331 | — | Ki | = | 5.5 | nM | 8.26 |
| CHEMBL32598 | — | Ki | = | 9.0 | nM | 8.05 |
| CHEMBL198326 | — | Ki | = | 18.0 | nM | 7.75 |
| CHEMBL418333 | — | Ki | = | 250.0 | nM | 6.60 |
| CHEMBL1355736 | THEOPHYLLINE | Ki | = | 9070.0 | nM | 5.04 |