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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 = 'BDBM50343506'   
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))
BDBM50343506
PNG
((R)-4-(4-(4-fluorophenyl)-2-(isopropylsulfinyl)-1H...)
Show SMILES CC(C)Nc1cc(ccn1)-c1nc([nH]c1-c1ccc(F)cc1)[S@](=O)C(C)C |r|
Show InChI InChI=1S/C20H23FN4OS/c1-12(2)23-17-11-15(9-10-22-17)19-18(14-5-7-16(21)8-6-14)24-20(25-19)27(26)13(3)4/h5-13H,1-4H3,(H,22,23)(H,24,25)/t27-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Eberhard-Karls-University Tu£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38 alpha MAPK in human whole blood assessed as phosphorylation of ATF-2 by immunosorbent non-radioactive enzyme assay


J Med Chem 54: 3283-97 (2011)


Article DOI: 10.1021/jm101623p
BindingDB Entry DOI: 10.7270/Q2W959H4
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50343506
PNG
((R)-4-(4-(4-fluorophenyl)-2-(isopropylsulfinyl)-1H...)
Show SMILES CC(C)Nc1cc(ccn1)-c1nc([nH]c1-c1ccc(F)cc1)[S@](=O)C(C)C |r|
Show InChI InChI=1S/C20H23FN4OS/c1-12(2)23-17-11-15(9-10-22-17)19-18(14-5-7-16(21)8-6-14)24-20(25-19)27(26)13(3)4/h5-13H,1-4H3,(H,22,23)(H,24,25)/t27-/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/a 450n/an/an/an/an/an/a



Eberhard-Karls-University Tu£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38 alpha MAPK in human whole blood assessed as suppression of LPS-induced TNF-alpha release by immunosorbent non-radioactive enzyme as...


J Med Chem 54: 3283-97 (2011)


Article DOI: 10.1021/jm101623p
BindingDB Entry DOI: 10.7270/Q2W959H4
More data for this
Ligand-Target Pair