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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 = 'BDBM50494277'   
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))
BDBM50494277
PNG
(CHEMBL3086693)
Show SMILES Nc1ccc2COc3cc(Nc4cc(F)c(F)cc4F)ccc3C(=O)c2c1
Show InChI InChI=1S/C20H13F3N2O2/c21-15-7-17(23)18(8-16(15)22)25-12-3-4-13-19(6-12)27-9-10-1-2-11(24)5-14(10)20(13)26/h1-8,25H,9,24H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 74n/an/an/an/an/an/a



Eberhard-Karls-University T£bingen

Curated by ChEMBL


Assay Description
Competitive inhibition of p38alpha MAP kinase (unknown origin) in presence of 100 uM ATP


J Med Chem 56: 8561-78 (2013)


Article DOI: 10.1021/jm401276h
BindingDB Entry DOI: 10.7270/Q2Q81H2C
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50494277
PNG
(CHEMBL3086693)
Show SMILES Nc1ccc2COc3cc(Nc4cc(F)c(F)cc4F)ccc3C(=O)c2c1
Show InChI InChI=1S/C20H13F3N2O2/c21-15-7-17(23)18(8-16(15)22)25-12-3-4-13-19(6-12)27-9-10-1-2-11(24)5-14(10)20(13)26/h1-8,25H,9,24H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.81E+3n/an/an/an/an/an/a



Eberhard-Karls-University T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha MAP kinase in human whole blood assessed as inhibition of LPS-induced TNFalpha release by ELISA


J Med Chem 56: 8561-78 (2013)


Article DOI: 10.1021/jm401276h
BindingDB Entry DOI: 10.7270/Q2Q81H2C
More data for this
Ligand-Target Pair