1-[(2S,3S)-3-[[5-fluoro-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]-2-bicyclo[2.2.2]octanyl]ethane-1,2-diol

InChIKey	`VAPOMSIOLKMAIW-DBPFDUESSA-N`
Compound Name	1-[(2S,3S)-3-[[5-fluoro-2-(5-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]amino]-2-bicyclo[2.2.2]octanyl]ethane-1,2-diol
Canonical SMILES	`OCC(O)[C@H]1C2CCC(CC2)[C@@H]1Nc1nc(-c2c[nH]c3ncc(F)cc23)ncc1F`
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	7
Pfam Stratification	Cross-Family
Avg pChEMBL	6.64
Source	ChEMBL

2D Structure

Activity Profile

Target	Gene	Organism	Category	Pfam	pChEMBL	Type	Source
P49840	GSK3A	Homo sapiens	Human	PF00069	7.1	Ki	ChEMBL
P49841	GSK3B	Homo sapiens	Human	PF00069	7.1	Ki	ChEMBL
P36888	FLT3	Homo sapiens	Human	PF00047 PF07714	6.8	Ki	ChEMBL
P17612	PRKACA	Homo sapiens	Human	PF00069	6.6	Ki	ChEMBL
O60674	JAK2	Homo sapiens	Human	PF18379 PF18377 PF17887 PF07714 PF21990	6.4	Ki	ChEMBL
P53350	PLK1	Homo sapiens	Human	PF00069 PF00659	6.3	Ki	ChEMBL
P48736	PIK3CG	Homo sapiens	Human	PF00454 PF00792 PF00794 PF00613 PF19710	6.2	Ki	ChEMBL