Molecule Details
InChIKeyOCUWNHFCHDFFHC-OAHLLOKOSA-N
Compound Name(R)-4-Amino-5-(4-{[(2,4-diamino-pyrido[2,3-d]pyrimidin-6-yl)-methyl-amino]-methyl}-benzoylamino)-5-oxo-pentanoic acid
Canonical SMILESCN(Cc1ccc(C(=O)NC(=O)[C@H](N)CCC(=O)O)cc1)c1cnc2nc(N)nc(N)c2c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.32
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P00374 DHFR Homo sapiens Human PF00186 6.2 IC50 ChEMBL;BindingDB
B0BL08 dfrA17 Escherichia coli Pathogen PF00186 7.9 IC50 BindingDB
P0ABQ4 folA Escherichia coli (strain K12) Pathogen PF00186 7.9 IC50 ChEMBL