Assay Detail
Binding
CHEMBL4156502
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Binding affinity to recombinant human carbonic anhydrase 12 (30 to 291 residues) expressed in Escherichia coli Rosetta 2 (DE3) strain in presence of ANS by fluorescent thermal shift 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
Design of two-tail compounds with rotationally fixed benzenesulfonamide ring as inhibitors of carbonic anhydrases.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| Kd | 26 | 6.63 | 7.68 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4165543 | — | — | 1 | 7.68 |
| CHEMBL4177268 | — | — | 1 | 7.53 |
| CHEMBL4168586 | — | — | 1 | 7.40 |
| CHEMBL4166643 | — | — | 1 | 7.36 |
| CHEMBL4160149 | — | — | 1 | 7.30 |
| CHEMBL4175740 | — | — | 1 | 6.97 |
| CHEMBL4172331 | — | — | 1 | 6.90 |
| CHEMBL4170792 | — | — | 1 | 6.90 |
| CHEMBL4165570 | — | — | 1 | 6.90 |
| CHEMBL4165896 | — | — | 1 | 6.90 |
| CHEMBL4168997 | — | — | 1 | 6.88 |
| CHEMBL4168966 | — | — | 1 | 6.78 |
| CHEMBL4173471 | — | — | 1 | 6.78 |
| CHEMBL4166964 | — | — | 1 | 6.70 |
| CHEMBL4170371 | — | — | 1 | 6.60 |
| CHEMBL4176862 | — | — | 1 | 6.48 |
| CHEMBL4163518 | — | — | 1 | 6.48 |
| CHEMBL4162133 | — | — | 1 | 6.48 |
| CHEMBL4173814 | — | — | 1 | 6.40 |
| CHEMBL120886 | — | — | 1 | 6.20 |
| CHEMBL4165127 | — | — | 1 | 6.20 |
| CHEMBL4159066 | — | — | 1 | 6.18 |
| CHEMBL4170058 | — | — | 1 | 5.89 |
| CHEMBL4173501 | — | — | 1 | 5.78 |
| CHEMBL4160627 | — | — | 1 | 5.70 |
| CHEMBL4174214 | — | — | 1 | 5.00 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4165543 | — | Kd | = | 20.8 | nM | 7.68 |
| CHEMBL4177268 | — | Kd | = | 29.4 | nM | 7.53 |
| CHEMBL4168586 | — | Kd | = | 40.0 | nM | 7.40 |
| CHEMBL4166643 | — | Kd | = | 43.5 | nM | 7.36 |
| CHEMBL4160149 | — | Kd | = | 50.0 | nM | 7.30 |
| CHEMBL4175740 | — | Kd | = | 108.0 | nM | 6.97 |
| CHEMBL4172331 | — | Kd | = | 125.0 | nM | 6.90 |
| CHEMBL4170792 | — | Kd | = | 125.0 | nM | 6.90 |
| CHEMBL4165570 | — | Kd | = | 125.0 | nM | 6.90 |
| CHEMBL4165896 | — | Kd | = | 125.0 | nM | 6.90 |
| CHEMBL4168997 | — | Kd | = | 133.0 | nM | 6.88 |
| CHEMBL4168966 | — | Kd | = | 167.0 | nM | 6.78 |
| CHEMBL4173471 | — | Kd | = | 167.0 | nM | 6.78 |
| CHEMBL4166964 | — | Kd | = | 200.0 | nM | 6.70 |
| CHEMBL4170371 | — | Kd | = | 250.0 | nM | 6.60 |
| CHEMBL4176862 | — | Kd | = | 333.0 | nM | 6.48 |
| CHEMBL4163518 | — | Kd | = | 333.0 | nM | 6.48 |
| CHEMBL4162133 | — | Kd | = | 333.0 | nM | 6.48 |
| CHEMBL4173814 | — | Kd | = | 400.0 | nM | 6.40 |
| CHEMBL120886 | — | Kd | = | 625.0 | nM | 6.20 |
| CHEMBL4165127 | — | Kd | = | 625.0 | nM | 6.20 |
| CHEMBL4159066 | — | Kd | = | 667.0 | nM | 6.18 |
| CHEMBL4170058 | — | Kd | = | 1280.0 | nM | 5.89 |
| CHEMBL4173501 | — | Kd | = | 1670.0 | nM | 5.78 |
| CHEMBL4160627 | — | Kd | = | 2000.0 | nM | 5.70 |
| CHEMBL4174214 | — | Kd | = | 10000.0 | nM | 5.00 |