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SMILES: CC(Nc1nc2cc[nH]c(=O)c2cc1-c1nc(no1)-c1ccccc1)C(C)(C)C

InChI Key: InChIKey=VPKHSUDBZGYCSR-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50331815   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))		BDBM50331815
PNG
(2-(3,3-dimethylbutan-2-ylamino)-3-(3-phenyl-1,2,4-...)
Show SMILES CC(Nc1nc2cc[nH]c(=O)c2cc1-c1nc(no1)-c1ccccc1)C(C)(C)C
Show InChI InChI=1S/C22H23N5O2/c1-13(22(2,3)4)24-19-16(12-15-17(25-19)10-11-23-20(15)28)21-26-18(27-29-21)14-8-6-5-7-9-14/h5-13H,1-4H3,(H,23,28)(H,24,25)
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n/an/a 1.15E+4n/an/an/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Inhibition of JAK2 in cell-free system

Bioorg Med Chem Lett 20: 7421-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.031
BindingDB Entry DOI: 10.7270/Q2SQ90MG
More data for this
Ligand-Target Pair