Molecule Details
| InChIKey | DZSMNKZDRKEEQX-UHFFFAOYSA-N |
|---|---|
| Compound Name | 7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-methylcoumarine (1a) |
| Canonical SMILES | Cc1cc(=O)oc2cc(OCCn3c([N+](=O)[O-])cnc3C)ccc12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 7 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.3 |
| Source | BindingDB |
2D Structure
Activity Profile
Target Activities (7)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q16790 | CA9 | Homo sapiens | Human | PF00194 | 6.4 | Ki | BindingDB |
| Q9Y2D0 | CA5B | Homo sapiens | Human | PF00194 | 6.4 | Ki | BindingDB |
| O43570 | CA12 | Homo sapiens | Human | PF00194 | 6.4 | Ki | BindingDB |
| P43166 | CA7 | Homo sapiens | Human | PF00194 | 6.4 | Ki | BindingDB |
| P23280 | CA6 | Homo sapiens | Human | PF00194 | 6.3 | Ki | BindingDB |
| P35218 | CA5A | Homo sapiens | Human | PF00194 | 6.1 | Ki | BindingDB |
| Q9ULX7 | CA14 | Homo sapiens | Human | PF00194 | 6.0 | Ki | BindingDB |