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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dual specificity mitogen-activated protein kinase kinase 1' and Ligand = 'BDBM50187823'   
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
Dual specificity mitogen-activated protein kinase kinase 1


(Homo sapiens (Human))
BDBM50187823
PNG
(CHEMBL377591 | N-(cyclohexylmethyl)-3-hydroxy-5-(p...)
Show SMILES N=C(NCC1CCCCC1)c1c(Nc2cccnc2)s[nH]c1=O
Show InChI InChI=1S/C16H21N5OS/c17-14(19-9-11-5-2-1-3-6-11)13-15(22)21-23-16(13)20-12-7-4-8-18-10-12/h4,7-8,10-11,20H,1-3,5-6,9H2,(H2,17,19)(H,21,22)
PDB
MMDB

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Article
PubMed
n/an/a 1.23E+3n/an/an/an/an/an/a



Valeant Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Inhibition of MEK1


Bioorg Med Chem Lett 16: 3975-80 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.019
BindingDB Entry DOI: 10.7270/Q2SJ1K6C
More data for this
Ligand-Target Pair