Molecule Details
InChIKeyQSKYIEZFZIPLGJ-UHFFFAOYSA-N
Compound Name6-[(3-Fluorophenyl)methylsulfanyl]-2-(oxetan-3-ylmethyl)-5-phenylpyrazolo[3,4-d]pyrimidin-4-one
Canonical SMILESO=c1c2cn(CC3COC3)nc2nc(SCc2cccc(F)c2)n1-c1ccccc1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.59
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P47895 ALDH1A3 Homo sapiens Human PF00171 6.9 IC50 ChEMBL;BindingDB
P00352 ALDH1A1 Homo sapiens Human PF00171 6.6 IC50 ChEMBL;BindingDB
O94788 ALDH1A2 Homo sapiens Human PF00171 6.3 IC50 ChEMBL;BindingDB