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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 = 'BDBM50430455'   
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))
BDBM50430455
PNG
(CHEMBL2334711)
Show SMILES O=C(C1CC1)N1CCC[C@H](C1)Nc1cc(ccn1)-n1c(nc2ccccc12)-c1ccc2ccccc2c1 |r|
Show InChI InChI=1S/C31H29N5O/c37-31(22-12-13-22)35-17-5-8-25(20-35)33-29-19-26(15-16-32-29)36-28-10-4-3-9-27(28)34-30(36)24-14-11-21-6-1-2-7-23(21)18-24/h1-4,6-7,9-11,14-16,18-19,22,25H,5,8,12-13,17,20H2,(H,32,33)/t25-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/a 1.07E+4n/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))
BDBM50430455
PNG
(CHEMBL2334711)
Show SMILES O=C(C1CC1)N1CCC[C@H](C1)Nc1cc(ccn1)-n1c(nc2ccccc12)-c1ccc2ccccc2c1 |r|
Show InChI InChI=1S/C31H29N5O/c37-31(22-12-13-22)35-17-5-8-25(20-35)33-29-19-26(15-16-32-29)36-28-10-4-3-9-27(28)34-30(36)24-14-11-21-6-1-2-7-23(21)18-24/h1-4,6-7,9-11,14-16,18-19,22,25H,5,8,12-13,17,20H2,(H,32,33)/t25-/m1/s1
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 1.07E+4n/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