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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 8' and Ligand = 'BDBM50211441'   
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 8


(Homo sapiens (Human))
BDBM50211441
PNG
(4-(4-(1H-indol-3-yl)pyrimidin-2-ylamino)-N-ethylpi...)
Show SMILES CCNC(=O)N1CCC(CC1)Nc1nccc(n1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C20H24N6O/c1-2-21-20(27)26-11-8-14(9-12-26)24-19-22-10-7-18(25-19)16-13-23-17-6-4-3-5-15(16)17/h3-7,10,13-14,23H,2,8-9,11-12H2,1H3,(H,21,27)(H,22,24,25)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 74n/an/an/an/an/an/a



UCB

Curated by ChEMBL


Assay Description
Inhibition of JNK1


Bioorg Med Chem Lett 17: 3463-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.078
BindingDB Entry DOI: 10.7270/Q2959H7W
More data for this
Ligand-Target Pair