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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase kinase kinase 8' and Ligand = 'BDBM50194995'   
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
Mitogen-activated protein kinase kinase kinase 8


(Homo sapiens (Human))
BDBM50194995
PNG
(6-((1H-imidazol-4-yl)methylamino)-4-(3-chloro-4-fl...)
Show SMILES Fc1ccc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(NCc4cnc[nH]4)cc23)C#N)cc1Cl
Show InChI InChI=1S/C27H27ClFN7O2/c28-22-10-19(2-3-23(22)29)35-27-18(13-30)14-32-24-12-26(38-7-1-4-36-5-8-37-9-6-36)25(11-21(24)27)33-16-20-15-31-17-34-20/h2-3,10-12,14-15,17,33H,1,4-9,16H2,(H,31,34)(H,32,35)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.20E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of Tpl2 kinase by ELISA


Bioorg Med Chem Lett 16: 6067-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.102
BindingDB Entry DOI: 10.7270/Q2W958TR
More data for this
Ligand-Target Pair