4-({3-chloro-4-[(1-methyl-1H-imidazol-2-yl)thio]phenyl}amino)-7-[(1E)-4-(4-ethylpiperazin-1-yl)but-1-enyl]quinoline-3-carbonitrile

InChIKey	`OYAMULIHRWEUAR-GQCTYLIASA-N`
Compound Name	4-({3-chloro-4-[(1-methyl-1H-imidazol-2-yl)thio]phenyl}amino)-7-[(1E)-4-(4-ethylpiperazin-1-yl)but-1-enyl]quinoline-3-carbonitrile
Canonical SMILES	`CCN1CCN(CC/C=C/c2ccc3c(Nc4ccc(Sc5nccn5C)c(Cl)c4)c(C#N)cnc3c2)CC1`
Clinical Status	Clinical Multi-Target
Targets (Human+Pathogen)	7
Pfam Stratification	Cross-Family
Avg pChEMBL	6.96
Source	ChEMBL;BindingDB;TTD_MultiTarget

2D Structure

Activity Profile

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
P00533	EGFR	Homo sapiens	Human	PF00757 PF14843 PF07714 PF01030 PF21314	8.0	IC50	ChEMBL;BindingDB
Q02750	MAP2K1	Homo sapiens	Human	PF00069	7.3	IC50	ChEMBL;BindingDB
P12931	SRC	Homo sapiens	Human	PF07714 PF00017 PF00018	7.3	IC50	ChEMBL;BindingDB
P07948	LYN	Homo sapiens	Human	PF07714 PF00017 PF00018	7.2	IC50	ChEMBL;BindingDB
P15056	BRAF	Homo sapiens	Human	PF00130 PF07714 PF02196	6.0	pIC50	TTD_MultiTarget
P35968	KDR	Homo sapiens	Human	PF07679 PF00047 PF13895 PF22971 PF07714 PF21339 PF17988 PF22854	6.0	IC50	ChEMBL;BindingDB
Q5VT25	CDC42BPA	Homo sapiens	Human	PF00130 PF00780 PF08826 PF15796 PF25346 PF00069 PF00433	Clinical	TTD_MultiTarget	TTD_MultiTarget