Molecule Details
InChIKeyVNDRTKUEQIBKJY-UHFFFAOYSA-N
Compound NameMethyl 2-((1H-Imidazol-1-yl)methyl)-4-(2-chloro-4-fluorophenyl)-5-cyano-6-methyl-1,4-dihydropyridine-3-carboxylate
Canonical SMILESCOC(=O)C1=C(Cn2ccnc2)N=C(C)C(C#N)C1c1ccc(F)cc1Cl
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Cross-Family
Avg pChEMBL6.92
SourceBindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P08235 NR3C2 Homo sapiens Human PF00104 PF00105 8.1 IC50 BindingDB
P08684 CYP3A4 Homo sapiens Human PF00067 6.7 IC50 BindingDB
P11712 CYP2C9 Homo sapiens Human PF00067 6.0 IC50 BindingDB