Molecule Details
InChIKeyDUORQQSLNAGSSQ-UHFFFAOYSA-N
Compound Name4-[3-(4-Cyanophenyl)-1-hydroxy-1-(3-methylimidazol-4-yl)prop-2-ynyl]-2-(2-methylphenyl)benzonitrile
Canonical SMILESCc1ccccc1-c1cc(C(O)(C#Cc2ccc(C#N)cc2)c2cncn2C)ccc1C#N
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL8.28
SourceChEMBL;BindingDB;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P49354 FNTA Homo sapiens Human PF01239 9.1 pIC50 TTD_MultiTarget
P49356 FNTB Homo sapiens Human PF00432 9.1 IC50 ChEMBL
P53609 PGGT1B Homo sapiens Human PF00432 6.7 IC50 ChEMBL;BindingDB