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BDBM50430443 CHEMBL2334723

SMILES: Clc1ccc(cc1Cl)-c1nc2ccccc2n1-c1ccnc(NC2CCOCC2)n1

InChI Key: InChIKey=NUBHHICZZNJVSS-UHFFFAOYSA-N

Data: 2 Kd

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50430443   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50430443
PNG
(CHEMBL2334723)
Show SMILES Clc1ccc(cc1Cl)-c1nc2ccccc2n1-c1ccnc(NC2CCOCC2)n1
Show InChI InChI=1S/C22H19Cl2N5O/c23-16-6-5-14(13-17(16)24)21-27-18-3-1-2-4-19(18)29(21)20-7-10-25-22(28-20)26-15-8-11-30-12-9-15/h1-7,10,13,15H,8-9,11-12H2,(H,25,26,28)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 2.18E+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))
BDBM50430443
PNG
(CHEMBL2334723)
Show SMILES Clc1ccc(cc1Cl)-c1nc2ccccc2n1-c1ccnc(NC2CCOCC2)n1
Show InChI InChI=1S/C22H19Cl2N5O/c23-16-6-5-14(13-17(16)24)21-27-18-3-1-2-4-19(18)29(21)20-7-10-25-22(28-20)26-15-8-11-30-12-9-15/h1-7,10,13,15H,8-9,11-12H2,(H,25,26,28)
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 2.18E+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