Molecule Details
| InChIKey | IRUMWXSHFZXEDQ-UHFFFAOYSA-N |
|---|---|
| Compound Name | Mls001181924 |
| Canonical SMILES | O=c1ccc2c(-c3ccccc3)c3ccc(O)cc3oc-2c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.52 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q5J463 | tem-1 | Salmonella choleraesuis (strain SC-B67) | Pathogen | PF13354 | 6.7 | IC50 | ChEMBL;BindingDB |
| Q932Y6 | bla(tem-2) | Pseudomonas aeruginosa | Pathogen | PF13354 | 6.4 | IC50 | ChEMBL;BindingDB |
| Q79MP6 | blaIMP-1 | Pseudomonas aeruginosa | Pathogen | PF00753 | 6.4 | IC50 | ChEMBL;BindingDB |