Assay Detail
Binding
CHEMBL1041798
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Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Homo sapiens |
| Confidence | 9 — Direct single protein target |
| Curated By | Intermediate |
Publication
Deciphering the mechanism of carbonic anhydrase inhibition with coumarins and thiocoumarins.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 21 | 5.40 | 7.23 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL568416 | — | — | 1 | 7.23 |
| CHEMBL568348 | — | — | 1 | 7.18 |
| CHEMBL572366 | — | — | 1 | 7.11 |
| CHEMBL567139 | — | — | 1 | 7.00 |
| CHEMBL6466 | COUMARIN | 4.0 | 1 | 5.51 |
| CHEMBL12567 | — | — | 1 | 5.43 |
| CHEMBL49732 | HERNIARIN | — | 1 | 5.23 |
| CHEMBL577123 | — | — | 1 | 5.17 |
| CHEMBL568417 | — | — | 1 | 5.04 |
| CHEMBL83294 | COUMARIN-3-CARBOXYLIC ACID | — | 1 | 5.03 |
| CHEMBL571519 | — | — | 1 | 4.91 |
| CHEMBL568516 | 7-PROPOXYCOUMARIN | — | 1 | 4.64 |
| CHEMBL145781 | 7-BENZYLOXYCOUMARIN | — | 1 | 4.57 |
| CHEMBL191528 | ETHOXYCOUMARIN | — | 1 | 4.50 |
| CHEMBL567544 | — | — | 1 | 4.50 |
| CHEMBL571514 | 7-BUTOXYCOUMARIN | — | 1 | 4.43 |
| CHEMBL578167 | — | — | 1 | 4.35 |
| CHEMBL571738 | — | — | 1 | - |
| CHEMBL568385 | — | — | 1 | - |
| CHEMBL567896 | — | — | 1 | - |
| CHEMBL568173 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL568416 | — | Ki | = | 59.0 | nM | 7.23 |
| CHEMBL568348 | — | Ki | = | 66.0 | nM | 7.18 |
| CHEMBL572366 | — | Ki | = | 78.0 | nM | 7.11 |
| CHEMBL567139 | — | Ki | = | 99.0 | nM | 7.00 |
| CHEMBL6466 | COUMARIN | Ki | = | 3100.0 | nM | 5.51 |
| CHEMBL12567 | — | Ki | = | 3720.0 | nM | 5.43 |
| CHEMBL49732 | HERNIARIN | Ki | = | 5900.0 | nM | 5.23 |
| CHEMBL577123 | — | Ki | = | 6800.0 | nM | 5.17 |
| CHEMBL568417 | — | Ki | = | 9200.0 | nM | 5.04 |
| CHEMBL83294 | COUMARIN-3-CARBOXYLIC ACID | Ki | = | 9300.0 | nM | 5.03 |
| CHEMBL571519 | — | Ki | = | 12400.0 | nM | 4.91 |
| CHEMBL568516 | 7-PROPOXYCOUMARIN | Ki | = | 23100.0 | nM | 4.64 |
| CHEMBL145781 | 7-BENZYLOXYCOUMARIN | Ki | = | 26900.0 | nM | 4.57 |
| CHEMBL191528 | ETHOXYCOUMARIN | Ki | = | 31400.0 | nM | 4.50 |
| CHEMBL567544 | — | Ki | = | 31400.0 | nM | 4.50 |
| CHEMBL571514 | 7-BUTOXYCOUMARIN | Ki | = | 37000.0 | nM | 4.43 |
| CHEMBL578167 | — | Ki | = | 44700.0 | nM | 4.35 |
| CHEMBL571738 | — | Ki | = | 243000.0 | nM | - |
| CHEMBL568385 | — | Ki | = | 224000.0 | nM | - |
| CHEMBL567896 | — | Ki | = | 145000.0 | nM | - |
| CHEMBL568173 | — | Ki | = | 213000.0 | nM | - |