Assay Detail
Binding
CHEMBL3760251
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Inhibition of human carbonic anhydrase 12 catalytic domain by Stopped-Flow CO2 Hydrase assay
26
Total Activities
26
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
Thioxocoumarins Show an Alternative Carbonic Anhydrase Inhibition Mechanism Compared to Coumarins.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 26 | 6.07 | 8.30 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3623663 | — | — | 1 | 8.30 |
| CHEMBL20 | ACETAZOLAMIDE | 4.0 | 1 | 8.22 |
| CHEMBL3758827 | — | — | 1 | 7.57 |
| CHEMBL1957175 | — | — | 1 | 6.55 |
| CHEMBL1957176 | — | — | 1 | 6.51 |
| CHEMBL1955879 | — | — | 1 | 6.50 |
| CHEMBL1957177 | — | — | 1 | 6.47 |
| CHEMBL1957179 | — | — | 1 | 6.46 |
| CHEMBL3121782 | — | — | 1 | 6.43 |
| CHEMBL3760055 | — | — | 1 | 6.39 |
| CHEMBL432745 | 7-ALLYLOXYCOUMARIN | — | 1 | 6.19 |
| CHEMBL243263 | 6-HYDROXYCOUMARIN | — | 1 | 6.17 |
| CHEMBL308819 | — | — | 1 | 6.14 |
| CHEMBL51628 | UMBELLIFERONE | — | 1 | 6.12 |
| CHEMBL1957172 | — | — | 1 | 6.10 |
| CHEMBL1957178 | — | — | 1 | 6.08 |
| CHEMBL1957180 | — | — | 1 | 6.06 |
| CHEMBL1957181 | — | — | 1 | 5.90 |
| CHEMBL1957183 | — | — | 1 | 5.90 |
| CHEMBL1957182 | — | — | 1 | 5.55 |
| CHEMBL301141 | 4-HYDROXYCOUMARINS | — | 1 | 5.20 |
| CHEMBL3760092 | — | — | 1 | 4.58 |
| CHEMBL3758522 | — | — | 1 | 4.41 |
| CHEMBL3759932 | — | — | 1 | 4.02 |
| CHEMBL3759409 | — | — | 1 | 4.02 |
| CHEMBL6466 | COUMARIN | 4.0 | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3623663 | — | Ki | = | 5.0 | nM | 8.30 |
| CHEMBL20 | ACETAZOLAMIDE | Ki | = | 6.0 | nM | 8.22 |
| CHEMBL3758827 | — | Ki | = | 27.0 | nM | 7.57 |
| CHEMBL1957175 | — | Ki | = | 280.0 | nM | 6.55 |
| CHEMBL1957176 | — | Ki | = | 310.0 | nM | 6.51 |
| CHEMBL1955879 | — | Ki | = | 320.0 | nM | 6.50 |
| CHEMBL1957177 | — | Ki | = | 340.0 | nM | 6.47 |
| CHEMBL1957179 | — | Ki | = | 350.0 | nM | 6.46 |
| CHEMBL3121782 | — | Ki | = | 370.0 | nM | 6.43 |
| CHEMBL3760055 | — | Ki | = | 410.0 | nM | 6.39 |
| CHEMBL432745 | 7-ALLYLOXYCOUMARIN | Ki | = | 640.0 | nM | 6.19 |
| CHEMBL243263 | 6-HYDROXYCOUMARIN | Ki | = | 680.0 | nM | 6.17 |
| CHEMBL308819 | — | Ki | = | 730.0 | nM | 6.14 |
| CHEMBL51628 | UMBELLIFERONE | Ki | = | 750.0 | nM | 6.12 |
| CHEMBL1957172 | — | Ki | = | 800.0 | nM | 6.10 |
| CHEMBL1957178 | — | Ki | = | 830.0 | nM | 6.08 |
| CHEMBL1957180 | — | Ki | = | 880.0 | nM | 6.06 |
| CHEMBL1957181 | — | Ki | = | 1250.0 | nM | 5.90 |
| CHEMBL1957183 | — | Ki | = | 1270.0 | nM | 5.90 |
| CHEMBL1957182 | — | Ki | = | 2830.0 | nM | 5.55 |
| CHEMBL301141 | 4-HYDROXYCOUMARINS | Ki | = | 6300.0 | nM | 5.20 |
| CHEMBL3760092 | — | Ki | = | 26500.0 | nM | 4.58 |
| CHEMBL3758522 | — | Ki | = | 38900.0 | nM | 4.41 |
| CHEMBL3759932 | — | Ki | = | 96000.0 | nM | 4.02 |
| CHEMBL3759409 | — | Ki | = | 95200.0 | nM | 4.02 |
| CHEMBL6466 | COUMARIN | Ki | > | 100000.0 | nM | - |