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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mitogen-activated protein kinase 14' and Ligand = 'BDBM50135319'   
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))
BDBM50135319
PNG
(1-(2-Chloro-6-trifluoromethyl-phenyl)-6-(4-fluoro-...)
Show SMILES Fc1ccc(Sc2ccc3N(C(=O)NCc3n2)c2c(Cl)cccc2C(F)(F)F)cc1
Show InChI InChI=1S/C20H12ClF4N3OS/c21-14-3-1-2-13(20(23,24)25)18(14)28-16-8-9-17(27-15(16)10-26-19(28)29)30-12-6-4-11(22)5-7-12/h1-9H,10H2,(H,26,29)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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Similars

PubMed
n/an/a 110n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against Mitogen-activated protein kinase p38 alpha


Bioorg Med Chem Lett 13: 3979-82 (2003)


BindingDB Entry DOI: 10.7270/Q2RJ4HWB
More data for this
Ligand-Target Pair