Molecule Details
InChIKeyZLVGYQMTSKBKPJ-UHFFFAOYSA-N
Compound Name3-[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenoxymethyl]-1-(3,4-dimethylphenyl)-5-phenyl-1H-pyrazole
Canonical SMILESCOC1(c2cc(F)cc(OCc3cc(-c4ccccc4)n(-c4ccc(C)c(C)c4)n3)c2)CCOCC1
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.3
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P23219 PTGS1 Homo sapiens Human PF03098 6.4 pIC50 TTD_MultiTarget
P35354 PTGS2 Homo sapiens Human PF03098 6.4 IC50 ChEMBL;BindingDB
P09917 ALOX5 Homo sapiens Human PF00305 PF01477 6.1 IC50 ChEMBL;BindingDB