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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Myosin light chain kinase, smooth muscle' and Ligand = 'BDBM50329500'   
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
Myosin light chain kinase, smooth muscle


(Homo sapiens (Human))
BDBM50329500
PNG
(4-chloro-N-(2-(phenethylamino)pyrimidin-4-yl)benze...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)Nc1ccnc(NCCc2ccccc2)n1
Show InChI InChI=1S/C18H17ClN4O2S/c19-15-6-8-16(9-7-15)26(24,25)23-17-11-13-21-18(22-17)20-12-10-14-4-2-1-3-5-14/h1-9,11,13H,10,12H2,(H2,20,21,22,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.10E+4n/an/an/an/an/an/a



Dainippon Sumitomo Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of MLCK


Bioorg Med Chem Lett 20: 6696-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.005
BindingDB Entry DOI: 10.7270/Q2RJ4JQH
More data for this
Ligand-Target Pair