Molecule Details
InChIKeyBFCRRLMMHNLSCP-UHFFFAOYSA-N
Compound NameBrodimoprim
Canonical SMILESCOc1cc(Cc2cnc(N)nc2N)cc(OC)c1Br
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.51
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB13795
Drug NameBrodimoprim
CAS Number56518-41-3
Groups experimental
ATC Codes J01EA02
Descriptionnan

Categories: Anti-Infective Agents Antibacterials for Systemic Use Antiinfectives for Systemic Use Enzyme Inhibitors Folic Acid Antagonists Pyrimidines Sulfonamides and trimethoprim Trimethoprim and Derivatives
Cross-references: BindingDB: 50027970 ChEBI: 131726 CHEMBL31891 ChemSpider: 62004 D07238 RxCUI: 19727 Wikipedia: Brodimoprim ZINC: ZINC000000005824
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P0ABQ4 folA Escherichia coli (strain K12) Pathogen PF00186 8.9 IC50 ChEMBL
B0BL08 dfrA17 Escherichia coli Pathogen PF00186 8.9 IC50 BindingDB
Q07422 Toxoplasma gondii Pathogen PF00186 PF00303 7.8 IC50 ChEMBL;BindingDB