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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK3' and Ligand = 'BDBM50464522'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50464522
PNG
(CHEMBL4280709)
Show SMILES COc1cc(Nc2ncc(F)c(Nc3cccc(NC(=O)C=C)c3)n2)ccc1OCC(=O)N1CCOCC1
Show InChI InChI=1S/C26H27FN6O5/c1-3-23(34)29-17-5-4-6-18(13-17)30-25-20(27)15-28-26(32-25)31-19-7-8-21(22(14-19)36-2)38-16-24(35)33-9-11-37-12-10-33/h3-8,13-15H,1,9-12,16H2,2H3,(H,29,34)(H2,28,30,31,32)
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Article
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n/an/a 11n/an/an/an/an/an/a



The First Affiliated Hospital of Dalian Medical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal GST-tagged human JAK3 (781 to end residues) expressed in baculovirus infected Sf9 insect cells using Poly(4:1 Gl...


Eur J Med Chem 143: 1847-1857 (2018)


Article DOI: 10.1016/j.ejmech.2017.10.080
BindingDB Entry DOI: 10.7270/Q22V2JR3
More data for this
Ligand-Target Pair