Assay Detail
Binding
CHEMBL1762938
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of human cytosolic carbonic anhydrase 1 by stopped flow CO2 hydration assay
43
Total Activities
43
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
Carbonic anhydrase inhibitors. Inhibition of the β-class enzymes from the fungal pathogens Candida albicans and Cryptococcus neoformans with branched aliphatic/aromatic carboxylates and their derivatives.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Ki | 43 | 5.13 | 6.60 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL20 | ACETAZOLAMIDE | 4.0 | 1 | 6.60 |
| CHEMBL1762669 | — | — | 1 | 6.32 |
| CHEMBL1762668 | METHYL 4-METHOXYBENZOATE | — | 1 | 5.42 |
| CHEMBL1762662 | — | — | 1 | 5.41 |
| CHEMBL1762663 | — | — | 1 | 5.41 |
| CHEMBL1762664 | — | — | 1 | 5.41 |
| CHEMBL1762661 | — | — | 1 | 5.39 |
| CHEMBL449635 | — | — | 1 | 5.36 |
| CHEMBL1762665 | — | — | 1 | 5.36 |
| CHEMBL1762666 | — | — | 1 | 5.32 |
| CHEMBL1081233 | — | — | 1 | 5.19 |
| CHEMBL1762660 | — | — | 1 | 5.16 |
| CHEMBL1762651 | — | — | 1 | 5.13 |
| CHEMBL1762656 | — | — | 1 | 5.12 |
| CHEMBL1762652 | — | — | 1 | 5.12 |
| CHEMBL1588015 | — | — | 1 | 5.11 |
| CHEMBL1762653 | — | — | 1 | 5.10 |
| CHEMBL1762654 | — | — | 1 | 5.09 |
| CHEMBL1762658 | AMINOBENZOATE SODIUM | -1.0 | 1 | 5.08 |
| CHEMBL1762667 | — | — | 1 | 5.07 |
| CHEMBL1762655 | — | — | 1 | 5.06 |
| CHEMBL1762659 | — | — | 1 | 5.06 |
| CHEMBL1762657 | — | — | 1 | 5.04 |
| CHEMBL21932 | p-ANISIC ACID | — | 1 | 5.04 |
| CHEMBL1354 | SODIUM ACETATE | 4.0 | 1 | 4.97 |
| CHEMBL509357 | SODIUM VALERATE | — | 1 | 4.26 |
| CHEMBL368444 | — | — | 1 | 4.13 |
| CHEMBL1762648 | — | — | 1 | 4.04 |
| CHEMBL1762644 | — | — | 1 | 4.01 |
| CHEMBL1762645 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL20 | ACETAZOLAMIDE | Ki | = | 250.0 | nM | 6.60 |
| CHEMBL1762669 | — | Ki | = | 480.0 | nM | 6.32 |
| CHEMBL1762668 | METHYL 4-METHOXYBENZOATE | Ki | = | 3840.0 | nM | 5.42 |
| CHEMBL1762662 | — | Ki | = | 3880.0 | nM | 5.41 |
| CHEMBL1762663 | — | Ki | = | 3940.0 | nM | 5.41 |
| CHEMBL1762664 | — | Ki | = | 3880.0 | nM | 5.41 |
| CHEMBL1762661 | — | Ki | = | 4040.0 | nM | 5.39 |
| CHEMBL449635 | — | Ki | = | 4340.0 | nM | 5.36 |
| CHEMBL1762665 | — | Ki | = | 4380.0 | nM | 5.36 |
| CHEMBL1762666 | — | Ki | = | 4810.0 | nM | 5.32 |
| CHEMBL1081233 | — | Ki | = | 6480.0 | nM | 5.19 |
| CHEMBL1762660 | — | Ki | = | 6920.0 | nM | 5.16 |
| CHEMBL1762651 | — | Ki | = | 7390.0 | nM | 5.13 |
| CHEMBL1762656 | — | Ki | = | 7610.0 | nM | 5.12 |
| CHEMBL1762652 | — | Ki | = | 7610.0 | nM | 5.12 |
| CHEMBL1588015 | — | Ki | = | 7840.0 | nM | 5.11 |
| CHEMBL1762653 | — | Ki | = | 8000.0 | nM | 5.10 |
| CHEMBL1762654 | — | Ki | = | 8180.0 | nM | 5.09 |
| CHEMBL1762658 | AMINOBENZOATE SODIUM | Ki | = | 8400.0 | nM | 5.08 |
| CHEMBL1762667 | — | Ki | = | 8510.0 | nM | 5.07 |
| CHEMBL1762659 | — | Ki | = | 8790.0 | nM | 5.06 |
| CHEMBL1762655 | — | Ki | = | 8800.0 | nM | 5.06 |
| CHEMBL1762657 | — | Ki | = | 9060.0 | nM | 5.04 |
| CHEMBL21932 | p-ANISIC ACID | Ki | = | 9060.0 | nM | 5.04 |
| CHEMBL1354 | SODIUM ACETATE | Ki | = | 10800.0 | nM | 4.97 |
| CHEMBL509357 | SODIUM VALERATE | Ki | = | 55300.0 | nM | 4.26 |
| CHEMBL368444 | — | Ki | = | 74000.0 | nM | 4.13 |
| CHEMBL1762648 | — | Ki | = | 92000.0 | nM | 4.04 |
| CHEMBL1762644 | — | Ki | = | 98000.0 | nM | 4.01 |
| CHEMBL1356 | SODIUM BENZOATE | Ki | = | 730000.0 | nM | - |
| CHEMBL1762650 | — | Ki | = | 101000.0 | nM | - |
| CHEMBL183491 | SODIUM FORMATE | Ki | = | 1040000.0 | nM | - |
| CHEMBL1762649 | — | Ki | = | 380000.0 | nM | - |
| CHEMBL1762647 | — | Ki | = | 450000.0 | nM | - |
| CHEMBL1762646 | — | Ki | = | 420000.0 | nM | - |
| CHEMBL1762643 | — | Ki | = | 104000.0 | nM | - |
| CHEMBL1162485 | 2-ETHYLHEXANOIC ACID | Ki | = | 450000.0 | nM | - |
| CHEMBL12569 | — | Ki | = | 310000.0 | nM | - |
| CHEMBL1762642 | SODIUM ISOVALERATE | Ki | = | 300000.0 | nM | - |
| CHEMBL1762641 | SODIUM ISOBUTYRATE | Ki | = | 120000.0 | nM | - |
| CHEMBL62381 | SODIUM BUTYRATE | Ki | = | 511000.0 | nM | - |
| CHEMBL500826 | SODIUM PROPIONATE | Ki | = | 1010000.0 | nM | - |
| CHEMBL1762645 | — | Ki | = | 380000.0 | nM | - |