Molecule Details
| InChIKey | JYGFUXUBGZBBAC-RCRIAUEHSA-M |
|---|---|
| Compound Name | Sodium; (2S,3R,5R)-3-((Z)-2-cyano-vinyl)-3-methyl-4,4,7-trioxo-4lambda*6*-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylate |
| Canonical SMILES | C[C@]1(/C=C/C#N)[C@H](C(=O)[O-])N2C(=O)C[C@H]2S1(=O)=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.81 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q2V0Y6 | pse-1 | Escherichia coli | Pathogen | PF13354 | 7.0 | IC50 | ChEMBL;BindingDB |
| P13661 | OXA-1 | Escherichia coli | Pathogen | PF00905 | 7.0 | IC50 | ChEMBL;BindingDB |
| P62593 | bla | Escherichia coli | Pathogen | PF13354 | 6.9 | IC50 | ChEMBL;BindingDB |
| P00807 | blaZ | Staphylococcus aureus | Pathogen | PF13354 PF08139 | 6.6 | IC50 | ChEMBL;BindingDB |
| P00808 | penP | Bacillus licheniformis | Pathogen | PF13354 | 6.5 | IC50 | ChEMBL;BindingDB |