Molecule Details
| InChIKey | IWLMYDRUZFJVAL-UHFFFAOYSA-N |
|---|---|
| Compound Name | 2-[[3-[[Methylsulfonyl-[(4-sulfamoylphenyl)methyl]amino]methyl]phenyl]amino]ethanoic acid |
| Canonical SMILES | CS(=O)(=O)N(Cc1ccc(S(N)(=O)=O)cc1)Cc1cccc(NCC(=O)O)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.77 |
| 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 |
| P22748 | CA4 | Homo sapiens | Human | PF00194 | 7.8 | Ki | ChEMBL |
| P00915 | CA1 | Homo sapiens | Human | PF00194 | 7.7 | Ki | ChEMBL |
| O43570 | CA12 | Homo sapiens | Human | PF00194 | 7.1 | Ki | ChEMBL |