Molecule Details
InChIKeyKEPLBUUTAQCZOE-AWEZNQCLSA-N
Compound Name6-Ethyl-5-{(3r)-3-[3-Methoxy-5-(Pyridin-4-Yl)phenyl]but-1-Yn-1-Yl}pyrimidine-2,4-Diamine
Canonical SMILESCCc1nc(N)nc(N)c1C#C[C@H](C)c1cc(OC)cc(-c2ccncc2)c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.25
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P0A017 folA Staphylococcus aureus Pathogen PF00186 7.8 Ki ChEMBL;BindingDB
P22906 DFR1 Candida albicans Pathogen PF00186 7.2 IC50 BindingDB
J7IFZ2 Streptococcus pyogenes Pathogen PF00186 6.7 IC50 BindingDB