Molecule Details
InChIKeyBAQFYLRUANWUHZ-WWAJHOSQSA-M
Compound NameSodium; (R)-5,5,8-trioxo-3-[(E)-2-(1-oxy-pyridin-2-yl)-vinyl]-7-[1-pyridin-2-yl-meth-(Z)-ylidene]-5lambda*6*-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylate
Canonical SMILESO=C([O-])C1=C(/C=C/c2cccc[n+]2[O-])CS(=O)(=O)[C@@H]2/C(=C\c3ccccn3)C(=O)N12
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL7.68
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q6W9J1 blaTEM-1 Enterobacter cloacae Pathogen PF13354 8.2 IC50 ChEMBL
Q7B899 bla Klebsiella pneumoniae Pathogen PF13354 8.2 IC50 BindingDB
Q59401 Enterobacter cloacae Pathogen PF00144 6.6 IC50 ChEMBL;BindingDB