3-cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1-pyrazolyl]propanenitrile

InChIKey	`HFNKQEVNSGCOJV-UHFFFAOYSA-N`
Compound Name	3-cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1-pyrazolyl]propanenitrile
Canonical SMILES	`N#CCC(C1CCCC1)n1cc(-c2ncnc3[nH]ccc23)cn1`
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	18
Pfam Stratification	Cross-Family
Avg pChEMBL	6.83
Source	ChEMBL;BindingDB

2D Structure

Activity Profile

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
O60674	JAK2	Homo sapiens	Human	PF18379 PF18377 PF17887 PF07714 PF21990	9.0	IC50	ChEMBL;BindingDB
P23458	JAK1	Homo sapiens	Human	PF18379 PF18377 PF17887 PF07714 PF21990	8.5	IC50	ChEMBL;BindingDB
P29376	LTK	Homo sapiens	Human	PF12810 PF07714	7.2	Ki	ChEMBL
Q5S007	LRRK2	Homo sapiens	Human	PF23745 PF23744 PF23748 PF16095 PF25497 PF13855 PF00069 PF08477	7.0	Ki	ChEMBL
O43293	DAPK3	Homo sapiens	Human	PF00069	7.0	Ki	ChEMBL
Q07912	TNK2	Homo sapiens	Human	PF09027 PF11555 PF07714 PF22931 PF14604	6.9	Ki	ChEMBL
P17612	PRKACA	Homo sapiens	Human	PF00069	6.8	Ki	ChEMBL
Q13464	ROCK1	Homo sapiens	Human	PF25346 PF00069 PF08912	6.8	Ki	ChEMBL
Q9HAZ1	CLK4	Homo sapiens	Human	PF00069	6.7	Ki	ChEMBL
Q9UQM7	CAMK2A	Homo sapiens	Human	PF08332 PF00069	6.7	Ki	ChEMBL
P52333	JAK3	Homo sapiens	Human	PF18379 PF18377 PF17887 PF07714 PF21990	6.6	IC50	ChEMBL;BindingDB
P07949	RET	Homo sapiens	Human	PF00028 PF07714 PF17756 PF17812 PF17813 PF22540	6.3	Ki	ChEMBL
Q8IU85	CAMK1D	Homo sapiens	Human	PF00069	6.3	Ki	ChEMBL
Q9UM73	ALK	Homo sapiens	Human	PF12810 PF00629 PF07714	6.3	Ki	ChEMBL
P34947	GRK5	Homo sapiens	Human	PF00069 PF00615	6.2	Ki	ChEMBL
Q7L7X3	TAOK1	Homo sapiens	Human	PF00069	6.2	Ki	ChEMBL
Q96GD4	AURKB	Homo sapiens	Human	PF00069	6.1	Ki	ChEMBL
Q9Y463	DYRK1B	Homo sapiens	Human	PF00069	6.1	Ki	ChEMBL