Molecule Details
| InChIKey | XOHXBAFZJQDMAH-UHFFFAOYSA-L |
|---|---|
| Canonical SMILES | Cc1ccc2c(c1)C1[O][Zn]3([Cl])([Cl])([O]C4C(=COc5ccc(C)cc54)C=[N+]3Cc3ccc(S(N)(=O)=O)cc3)[N+](Cc3ccc(S(N)(=O)=O)cc3)=CC1=CO2 |
| Clinical Status | Clinical Multi-Target |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.82 |
| Source | BindingDB;TTD_MultiTarget |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q16790 | CA9 | Homo sapiens | Human | PF00194 | 8.1 | Ki | BindingDB |
| O43570 | CA12 | Homo sapiens | Human | PF00194 | 8.1 | Ki | BindingDB |
| P00918 | CA2 | Homo sapiens | Human | PF00194 | 7.8 | Ki | BindingDB |
| P18505 | GABRB1 | Homo sapiens | Human | PF02931 PF02932 | 7.8 | pIC50 | TTD_MultiTarget |
| P00915 | CA1 | Homo sapiens | Human | PF00194 | 7.2 | Ki | BindingDB |