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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 = 'BDBM50109416'   
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))
BDBM50109416
PNG
(CHEMBL3601237)
Show SMILES OC1CCN(CC1)c1c(F)cc(Nc2ncc(Cl)c(NCc3cccc(NC(=O)C=C)c3)n2)cc1F
Show InChI InChI=1S/C25H25ClF2N6O2/c1-2-22(36)31-16-5-3-4-15(10-16)13-29-24-19(26)14-30-25(33-24)32-17-11-20(27)23(21(28)12-17)34-8-6-18(35)7-9-34/h2-5,10-12,14,18,35H,1,6-9,13H2,(H,31,36)(H2,29,30,32,33)
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Article
PubMed
n/an/a 7.40n/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