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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase PLK1' and Ligand = 'BDBM50275700'   
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
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM50275700
PNG
(5-methyl-7-(2-nitrophenyl)-N-(3,4,5-trimethoxyphen...)
Show SMILES COc1cc(Nc2ncc3c(C)nc(-c4ccccc4[N+]([O-])=O)n3n2)cc(OC)c1OC
Show InChI InChI=1S/C21H20N6O5/c1-12-16-11-22-21(24-13-9-17(30-2)19(32-4)18(10-13)31-3)25-26(16)20(23-12)14-7-5-6-8-15(14)27(28)29/h5-11H,1-4H3,(H,24,25)
PDB
MMDB

NCI pathway
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Similars

Article
PubMed
n/an/a 1.98E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of PLK1 (unknown origin) expressed in baculovirus infected Trichoplusia ni cells


Bioorg Med Chem Lett 18: 6214-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.100
BindingDB Entry DOI: 10.7270/Q22Z15DQ
More data for this
Ligand-Target Pair