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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 14' and Ligand = 'BDBM50425378'   
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 14


(Homo sapiens (Human))
BDBM50425378
PNG
(CHEMBL2316194)
Show SMILES CN1CCN(CCNC(=O)c2ccc3CCc4cc(Nc5ccc(F)cc5F)ccc4C(=O)c3c2)CC1
Show InChI InChI=1S/C29H30F2N4O2/c1-34-12-14-35(15-13-34)11-10-32-29(37)21-5-3-19-2-4-20-16-23(7-8-24(20)28(36)25(19)17-21)33-27-9-6-22(30)18-26(27)31/h3,5-9,16-18,33H,2,4,10-15H2,1H3,(H,32,37)
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



University of T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha MAP kinase (unknown origin) by ELISA


J Med Chem 56: 241-53 (2013)


Article DOI: 10.1021/jm301539x
BindingDB Entry DOI: 10.7270/Q2TB187B
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50425378
PNG
(CHEMBL2316194)
Show SMILES CN1CCN(CCNC(=O)c2ccc3CCc4cc(Nc5ccc(F)cc5F)ccc4C(=O)c3c2)CC1
Show InChI InChI=1S/C29H30F2N4O2/c1-34-12-14-35(15-13-34)11-10-32-29(37)21-5-3-19-2-4-20-16-23(7-8-24(20)28(36)25(19)17-21)33-27-9-6-22(30)18-26(27)31/h3,5-9,16-18,33H,2,4,10-15H2,1H3,(H,32,37)
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/a 27n/an/an/an/an/an/a



University of T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha MAP kinase in whole blood (unknown origin) assessed as lipopolysaccharide-stimulated TNF-alpha release by ELISA


J Med Chem 56: 241-53 (2013)


Article DOI: 10.1021/jm301539x
BindingDB Entry DOI: 10.7270/Q2TB187B
More data for this
Ligand-Target Pair