Assay Detail
Binding
CHEMBL4156503
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Binding affinity to recombinant human carbonic anhydrase 13 (1 to 262 residues) expressed in Escherichia coli Rosetta 2 (DE3) strain in presence of ANS by fluorescent thermal shift assay
24
Total Activities
24
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 | 24 | 6.15 | 6.74 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4173501 | — | — | 1 | 6.74 |
| CHEMBL4165127 | — | — | 1 | 6.54 |
| CHEMBL120886 | — | — | 1 | 6.48 |
| CHEMBL4165570 | — | — | 1 | 6.48 |
| CHEMBL4166643 | — | — | 1 | 6.43 |
| CHEMBL4168966 | — | — | 1 | 6.40 |
| CHEMBL4160149 | — | — | 1 | 6.40 |
| CHEMBL4175740 | — | — | 1 | 6.38 |
| CHEMBL4165896 | — | — | 1 | 6.30 |
| CHEMBL4168997 | — | — | 1 | 6.28 |
| CHEMBL4172331 | — | — | 1 | 6.25 |
| CHEMBL4173471 | — | — | 1 | 6.20 |
| CHEMBL4176828 | — | — | 1 | 6.18 |
| CHEMBL4168586 | — | — | 1 | 6.18 |
| CHEMBL4166964 | — | — | 1 | 6.15 |
| CHEMBL4162133 | — | — | 1 | 6.08 |
| CHEMBL4160627 | — | — | 1 | 6.04 |
| CHEMBL4170371 | — | — | 1 | 6.00 |
| CHEMBL4170792 | — | — | 1 | 5.96 |
| CHEMBL4173814 | — | — | 1 | 5.93 |
| CHEMBL4176862 | — | — | 1 | 5.70 |
| CHEMBL4163518 | — | — | 1 | 5.70 |
| CHEMBL4177268 | — | — | 1 | 5.60 |
| CHEMBL4170058 | — | — | 1 | 5.20 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4173501 | — | Kd | = | 182.0 | nM | 6.74 |
| CHEMBL4165127 | — | Kd | = | 286.0 | nM | 6.54 |
| CHEMBL120886 | — | Kd | = | 333.0 | nM | 6.48 |
| CHEMBL4165570 | — | Kd | = | 333.0 | nM | 6.48 |
| CHEMBL4166643 | — | Kd | = | 370.0 | nM | 6.43 |
| CHEMBL4168966 | — | Kd | = | 400.0 | nM | 6.40 |
| CHEMBL4160149 | — | Kd | = | 395.0 | nM | 6.40 |
| CHEMBL4175740 | — | Kd | = | 412.0 | nM | 6.38 |
| CHEMBL4165896 | — | Kd | = | 500.0 | nM | 6.30 |
| CHEMBL4168997 | — | Kd | = | 526.0 | nM | 6.28 |
| CHEMBL4172331 | — | Kd | = | 556.0 | nM | 6.25 |
| CHEMBL4173471 | — | Kd | = | 625.0 | nM | 6.20 |
| CHEMBL4176828 | — | Kd | = | 667.0 | nM | 6.18 |
| CHEMBL4168586 | — | Kd | = | 667.0 | nM | 6.18 |
| CHEMBL4166964 | — | Kd | = | 714.0 | nM | 6.15 |
| CHEMBL4162133 | — | Kd | = | 833.0 | nM | 6.08 |
| CHEMBL4160627 | — | Kd | = | 909.0 | nM | 6.04 |
| CHEMBL4170371 | — | Kd | = | 1000.0 | nM | 6.00 |
| CHEMBL4170792 | — | Kd | = | 1110.0 | nM | 5.96 |
| CHEMBL4173814 | — | Kd | = | 1180.0 | nM | 5.93 |
| CHEMBL4176862 | — | Kd | = | 2000.0 | nM | 5.70 |
| CHEMBL4163518 | — | Kd | = | 2000.0 | nM | 5.70 |
| CHEMBL4177268 | — | Kd | = | 2500.0 | nM | 5.60 |
| CHEMBL4170058 | — | Kd | = | 6250.0 | nM | 5.20 |