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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 356.3
BDBM16009

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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))
BDBM16009
PNG
(3-{[2-(phenylamino)pyrimidin-4-yl]amino}naphthalen...)
Show SMILES OC(=O)c1cc2ccccc2cc1Nc1ccnc(Nc2ccccc2)n1
Show InChI InChI=1S/C21H16N4O2/c26-20(27)17-12-14-6-4-5-7-15(14)13-18(17)24-19-10-11-22-21(25-19)23-16-8-2-1-3-9-16/h1-13H,(H,26,27)(H2,22,23,24,25)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 705n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
In vitro substrate phosphorylation using purified recombinant JNK, was incubated with substrate, and test compounds in the presence of 5uM ATP/ [gamm...


Bioorg Med Chem Lett 17: 668-72 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.093
BindingDB Entry DOI: 10.7270/Q2J964N4
More data for this
Ligand-Target Pair