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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 10' and Ligand = 'BDBM50430445'   
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 10


(Homo sapiens (Human))
BDBM50430445
PNG
(CHEMBL2334721)
Show SMILES COc1ccc2n(c(nc2c1)-c1ccc2ccccc2c1)-c1ccnc(NC2CCCCC2)n1
Show InChI InChI=1S/C28H27N5O/c1-34-23-13-14-25-24(18-23)31-27(21-12-11-19-7-5-6-8-20(19)17-21)33(25)26-15-16-29-28(32-26)30-22-9-3-2-4-10-22/h5-8,11-18,22H,2-4,9-10H2,1H3,(H,29,30,32)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/a 743n/an/an/an/an/a



Hanyang University

Curated by ChEMBL


Assay Description
Binding affinity to N-terminal His6X-tagged human recombinant JNK3 catalytic domain expressed in Escherichia coli BL21 (DE3) by surface plasmon reson...


Bioorg Med Chem 21: 2271-85 (2013)


Article DOI: 10.1016/j.bmc.2013.02.021
BindingDB Entry DOI: 10.7270/Q29W0GVC
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM50430445
PNG
(CHEMBL2334721)
Show SMILES COc1ccc2n(c(nc2c1)-c1ccc2ccccc2c1)-c1ccnc(NC2CCCCC2)n1
Show InChI InChI=1S/C28H27N5O/c1-34-23-13-14-25-24(18-23)31-27(21-12-11-19-7-5-6-8-20(19)17-21)33(25)26-15-16-29-28(32-26)30-22-9-3-2-4-10-22/h5-8,11-18,22H,2-4,9-10H2,1H3,(H,29,30,32)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/a 743n/an/an/an/an/a



Hanyang University

Curated by ChEMBL


Assay Description
Binding affinity to JNK3 (unknown origin) by surface plasmon resonance analysis in presence of ATP


Bioorg Med Chem Lett 23: 1639-42 (2013)


Article DOI: 10.1016/j.bmcl.2013.01.082
BindingDB Entry DOI: 10.7270/Q2F76DXD
More data for this
Ligand-Target Pair