Molecule Details
| InChIKey | YLLUSYOWHKIUSW-UHFFFAOYSA-L |
|---|---|
| Canonical SMILES | NS(=O)(=O)c1ccc(C[N]2CC3=COc4ccccc4C3[O][Zn]23([Cl])([Cl])[O]C2C(=COc4ccccc42)C[N]3Cc2ccc(S(N)(=O)=O)cc2)cc1 |
| Clinical Status | Clinical Multi-Target |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.25 |
| Source | BindingDB;TTD_MultiTarget |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P00918 | CA2 | Homo sapiens | Human | PF00194 | 8.7 | Ki | BindingDB |
| P18505 | GABRB1 | Homo sapiens | Human | PF02931 PF02932 | 8.7 | pIC50 | TTD_MultiTarget |
| Q16790 | CA9 | Homo sapiens | Human | PF00194 | 8.1 | Ki | BindingDB |
| P00915 | CA1 | Homo sapiens | Human | PF00194 | 7.9 | Ki | BindingDB |
| O43570 | CA12 | Homo sapiens | Human | PF00194 | 7.8 | Ki | BindingDB |