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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 = 'BDBM50430435'   
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))
BDBM50430435
PNG
(CHEMBL2334702)
Show SMILES Oc1ccc2n(c(nc2c1)-c1ccc2ccccc2c1)-c1ccnc(NC2CCOCC2)n1
Show InChI InChI=1S/C26H23N5O2/c32-21-7-8-23-22(16-21)29-25(19-6-5-17-3-1-2-4-18(17)15-19)31(23)24-9-12-27-26(30-24)28-20-10-13-33-14-11-20/h1-9,12,15-16,20,32H,10-11,13-14H2,(H,27,28,30)
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PC cid
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Similars

Article
PubMed
n/an/an/a 1.66E+3n/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))
BDBM50430435
PNG
(CHEMBL2334702)
Show SMILES Oc1ccc2n(c(nc2c1)-c1ccc2ccccc2c1)-c1ccnc(NC2CCOCC2)n1
Show InChI InChI=1S/C26H23N5O2/c32-21-7-8-23-22(16-21)29-25(19-6-5-17-3-1-2-4-18(17)15-19)31(23)24-9-12-27-26(30-24)28-20-10-13-33-14-11-20/h1-9,12,15-16,20,32H,10-11,13-14H2,(H,27,28,30)
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 1.66E+3n/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