Assay Detail
Binding
CHEMBL838835
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Binding affinity for alpha-2A adrenergic receptor
29
Total Activities
29
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Expert |
Publication
Discovery of a new series of centrally active tricyclic isoxazoles combining serotonin (5-HT) reuptake inhibition with alpha2-adrenoceptor blocking activity.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 29 | 8.57 | 10.00 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL176261 | — | — | 1 | 10.00 |
| CHEMBL435352 | — | — | 1 | 10.00 |
| CHEMBL180470 | — | — | 1 | 9.70 |
| CHEMBL176116 | — | — | 1 | 9.40 |
| CHEMBL176002 | — | — | 1 | 9.30 |
| CHEMBL175853 | — | — | 1 | 9.15 |
| CHEMBL2112978 | — | — | 1 | 9.05 |
| CHEMBL175911 | — | — | 1 | 9.05 |
| CHEMBL180322 | — | — | 1 | 9.05 |
| CHEMBL425324 | — | — | 1 | 9.00 |
| CHEMBL179237 | — | — | 1 | 8.89 |
| CHEMBL369378 | — | — | 1 | 8.89 |
| CHEMBL2112982 | — | — | 1 | 8.74 |
| CHEMBL2112972 | — | — | 1 | 8.74 |
| CHEMBL2112985 | — | — | 1 | 8.62 |
| CHEMBL2112984 | — | — | 1 | 8.40 |
| CHEMBL178588 | — | — | 1 | 8.33 |
| CHEMBL2112971 | — | — | 1 | 8.19 |
| CHEMBL2112983 | — | — | 1 | 8.10 |
| CHEMBL2112969 | — | — | 1 | 8.04 |
| CHEMBL2112977 | — | — | 1 | 7.96 |
| CHEMBL2112981 | — | — | 1 | 7.70 |
| CHEMBL2112973 | — | — | 1 | 7.70 |
| CHEMBL2112975 | — | — | 1 | 7.48 |
| CHEMBL2112979 | — | — | 1 | 7.37 |
| CHEMBL426959 | — | — | 1 | 7.33 |
| CHEMBL2112976 | — | — | 1 | 7.13 |
| CHEMBL2112980 | — | — | 1 | - |
| CHEMBL2112974 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL176261 | — | Ki | = | 0.1 | nM | 10.00 |
| CHEMBL435352 | — | Ki | = | 0.1 | nM | 10.00 |
| CHEMBL180470 | — | Ki | = | 0.2 | nM | 9.70 |
| CHEMBL176116 | — | Ki | = | 0.4 | nM | 9.40 |
| CHEMBL176002 | — | Ki | = | 0.5 | nM | 9.30 |
| CHEMBL175853 | — | Ki | = | 0.7 | nM | 9.15 |
| CHEMBL2112978 | — | Ki | = | 0.9 | nM | 9.05 |
| CHEMBL175911 | — | Ki | = | 0.9 | nM | 9.05 |
| CHEMBL180322 | — | Ki | = | 0.9 | nM | 9.05 |
| CHEMBL425324 | — | Ki | = | 1.0 | nM | 9.00 |
| CHEMBL179237 | — | Ki | = | 1.3 | nM | 8.89 |
| CHEMBL369378 | — | Ki | = | 1.3 | nM | 8.89 |
| CHEMBL2112982 | — | Ki | = | 1.8 | nM | 8.74 |
| CHEMBL2112972 | — | Ki | = | 1.8 | nM | 8.74 |
| CHEMBL2112985 | — | Ki | = | 2.4 | nM | 8.62 |
| CHEMBL2112984 | — | Ki | = | 4.0 | nM | 8.40 |
| CHEMBL178588 | — | Ki | = | 4.7 | nM | 8.33 |
| CHEMBL2112971 | — | Ki | = | 6.5 | nM | 8.19 |
| CHEMBL2112983 | — | Ki | = | 7.9 | nM | 8.10 |
| CHEMBL2112969 | — | Ki | = | 9.1 | nM | 8.04 |
| CHEMBL2112977 | — | Ki | = | 11.0 | nM | 7.96 |
| CHEMBL2112981 | — | Ki | = | 20.0 | nM | 7.70 |
| CHEMBL2112973 | — | Ki | = | 20.0 | nM | 7.70 |
| CHEMBL2112975 | — | Ki | = | 33.0 | nM | 7.48 |
| CHEMBL2112979 | — | Ki | = | 43.0 | nM | 7.37 |
| CHEMBL426959 | — | Ki | = | 47.0 | nM | 7.33 |
| CHEMBL2112976 | — | Ki | = | 74.0 | nM | 7.13 |
| CHEMBL2112980 | — | Ki | > | 1000.0 | nM | - |
| CHEMBL2112974 | — | Ki | > | 1000.0 | nM | - |