Assay Detail
Binding
CHEMBL1762941
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Inhibition of Candida albicans Nce103 beta-carbonic anhydrase by stopped flow CO2 hydration assay
36
Total Activities
36
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | Candida albicans |
| Confidence | 0 — Uncurated / Unknown |
| 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 | 36 | 5.61 | 6.96 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL1762656 | — | — | 1 | 6.96 |
| CHEMBL20 | ACETAZOLAMIDE | 4.0 | 1 | 6.89 |
| CHEMBL21932 | p-ANISIC ACID | — | 1 | 6.82 |
| CHEMBL1762657 | — | — | 1 | 6.82 |
| CHEMBL1762661 | — | — | 1 | 6.47 |
| CHEMBL1762669 | — | — | 1 | 6.33 |
| CHEMBL449635 | — | — | 1 | 6.27 |
| CHEMBL1762668 | METHYL 4-METHOXYBENZOATE | — | 1 | 6.21 |
| CHEMBL1588015 | — | — | 1 | 6.09 |
| CHEMBL1762642 | SODIUM ISOVALERATE | — | 1 | 6.02 |
| CHEMBL1762641 | SODIUM ISOBUTYRATE | — | 1 | 6.01 |
| CHEMBL1762651 | — | — | 1 | 5.96 |
| CHEMBL1762646 | — | — | 1 | 5.90 |
| CHEMBL1762644 | — | — | 1 | 5.67 |
| CHEMBL1762652 | — | — | 1 | 5.58 |
| CHEMBL1762658 | AMINOBENZOATE SODIUM | -1.0 | 1 | 5.53 |
| CHEMBL1762666 | — | — | 1 | 5.52 |
| CHEMBL1762659 | — | — | 1 | 5.47 |
| CHEMBL1762645 | — | — | 1 | 5.43 |
| CHEMBL1762653 | — | — | 1 | 5.38 |
| CHEMBL1762660 | — | — | 1 | 5.35 |
| CHEMBL1762667 | — | — | 1 | 5.34 |
| CHEMBL1762662 | — | — | 1 | 5.33 |
| CHEMBL1762655 | — | — | 1 | 5.31 |
| CHEMBL1762664 | — | — | 1 | 5.30 |
| CHEMBL1762654 | — | — | 1 | 5.29 |
| CHEMBL1762663 | — | — | 1 | 5.28 |
| CHEMBL1762665 | — | — | 1 | 5.25 |
| CHEMBL1081233 | — | — | 1 | 5.24 |
| CHEMBL12569 | — | — | 1 | 4.98 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL1762656 | — | Ki | = | 110.0 | nM | 6.96 |
| CHEMBL20 | ACETAZOLAMIDE | Ki | = | 130.0 | nM | 6.89 |
| CHEMBL1762657 | — | Ki | = | 150.0 | nM | 6.82 |
| CHEMBL21932 | p-ANISIC ACID | Ki | = | 150.0 | nM | 6.82 |
| CHEMBL1762661 | — | Ki | = | 340.0 | nM | 6.47 |
| CHEMBL1762669 | — | Ki | = | 470.0 | nM | 6.33 |
| CHEMBL449635 | — | Ki | = | 540.0 | nM | 6.27 |
| CHEMBL1762668 | METHYL 4-METHOXYBENZOATE | Ki | = | 610.0 | nM | 6.21 |
| CHEMBL1588015 | — | Ki | = | 810.0 | nM | 6.09 |
| CHEMBL1762642 | SODIUM ISOVALERATE | Ki | = | 950.0 | nM | 6.02 |
| CHEMBL1762641 | SODIUM ISOBUTYRATE | Ki | = | 980.0 | nM | 6.01 |
| CHEMBL1762651 | — | Ki | = | 1090.0 | nM | 5.96 |
| CHEMBL1762646 | — | Ki | = | 1250.0 | nM | 5.90 |
| CHEMBL1762644 | — | Ki | = | 2140.0 | nM | 5.67 |
| CHEMBL1762652 | — | Ki | = | 2650.0 | nM | 5.58 |
| CHEMBL1762658 | AMINOBENZOATE SODIUM | Ki | = | 2950.0 | nM | 5.53 |
| CHEMBL1762666 | — | Ki | = | 3050.0 | nM | 5.52 |
| CHEMBL1762659 | — | Ki | = | 3400.0 | nM | 5.47 |
| CHEMBL1762645 | — | Ki | = | 3730.0 | nM | 5.43 |
| CHEMBL1762653 | — | Ki | = | 4180.0 | nM | 5.38 |
| CHEMBL1762660 | — | Ki | = | 4470.0 | nM | 5.35 |
| CHEMBL1762667 | — | Ki | = | 4560.0 | nM | 5.34 |
| CHEMBL1762662 | — | Ki | = | 4710.0 | nM | 5.33 |
| CHEMBL1762655 | — | Ki | = | 4850.0 | nM | 5.31 |
| CHEMBL1762664 | — | Ki | = | 4970.0 | nM | 5.30 |
| CHEMBL1762654 | — | Ki | = | 5170.0 | nM | 5.29 |
| CHEMBL1762663 | — | Ki | = | 5200.0 | nM | 5.28 |
| CHEMBL1762665 | — | Ki | = | 5600.0 | nM | 5.25 |
| CHEMBL1081233 | — | Ki | = | 5700.0 | nM | 5.24 |
| CHEMBL12569 | — | Ki | = | 10400.0 | nM | 4.98 |
| CHEMBL1762650 | — | Ki | = | 10700.0 | nM | 4.97 |
| CHEMBL1762643 | — | Ki | = | 11100.0 | nM | 4.96 |
| CHEMBL1762648 | — | Ki | = | 11700.0 | nM | 4.93 |
| CHEMBL1762649 | — | Ki | = | 37900.0 | nM | 4.42 |
| CHEMBL1162485 | 2-ETHYLHEXANOIC ACID | Ki | = | 43100.0 | nM | 4.37 |
| CHEMBL1762647 | — | Ki | = | 43100.0 | nM | 4.37 |