Molecule Details
| InChIKey | SHYSXDCSVPDJHG-UHFFFAOYSA-N |
|---|---|
| Compound Name | 2-[3-[[(4-Bromophenyl)sulfonyl-[(4-sulfamoylphenyl)methyl]amino]methyl]anilino]acetic acid |
| Canonical SMILES | NS(=O)(=O)c1ccc(CN(Cc2cccc(NCC(=O)O)c2)S(=O)(=O)c2ccc(Br)cc2)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.67 |
| Source | ChEMBL |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q16790 | CA9 | Homo sapiens | Human | PF00194 | 8.2 | Ki | ChEMBL |
| P00918 | CA2 | Homo sapiens | Human | PF00194 | 8.1 | Ki | ChEMBL |
| P00915 | CA1 | Homo sapiens | Human | PF00194 | 7.4 | Ki | ChEMBL |
| O43570 | CA12 | Homo sapiens | Human | PF00194 | 7.4 | Ki | ChEMBL |
| P22748 | CA4 | Homo sapiens | Human | PF00194 | 7.2 | Ki | ChEMBL |