Methyl 4-(2-chloro-4-fluorophenyl)-5-cyano-6-methyl-2-(1,2,4-triazol-1-ylmethyl)-1,4-dihydropyridine-3-carboxylate

InChIKey	`MSXMGTMTOVJLOZ-UHFFFAOYSA-N`
Compound Name	Methyl 4-(2-chloro-4-fluorophenyl)-5-cyano-6-methyl-2-(1,2,4-triazol-1-ylmethyl)-1,4-dihydropyridine-3-carboxylate
Canonical SMILES	`COC(=O)C1=C(Cn2cncn2)NC(C)=C(C#N)C1c1ccc(F)cc1Cl`
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	3
Pfam Stratification	Cross-Family
Avg pChEMBL	6.67
Source	ChEMBL

2D Structure

Activity Profile

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
P11712	CYP2C9	Homo sapiens	Human	PF00067	7.0	IC50	ChEMBL
P08235	NR3C2	Homo sapiens	Human	PF00104 PF00105	6.9	IC50	ChEMBL
P08684	CYP3A4	Homo sapiens	Human	PF00067	6.1	IC50	ChEMBL