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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 = 'BDBM50109406'   
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))
BDBM50109406
PNG
(CHEMBL3601225)
Show SMILES COc1cc(N2CCN(C)CC2)c(C)cc1Nc1ncc(Cl)c(NCc2cccc(NC(=O)C=C)c2)n1
Show InChI InChI=1S/C27H32ClN7O2/c1-5-25(36)31-20-8-6-7-19(14-20)16-29-26-21(28)17-30-27(33-26)32-22-13-18(2)23(15-24(22)37-4)35-11-9-34(3)10-12-35/h5-8,13-15,17H,1,9-12,16H2,2-4H3,(H,31,36)(H2,29,30,32,33)
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Similars

Article
PubMed
n/an/a 170n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of JAK3 (unknown origin) by Z'-Lyte assay


J Med Chem 58: 6589-606 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00710
BindingDB Entry DOI: 10.7270/Q2833TSH
More data for this
Ligand-Target Pair