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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 = 'BDBM50357897'   
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))
BDBM50357897
PNG
(CHEMBL1916354)
Show SMILES Cc1cc(NS(C)(=O)=O)ccc1-c1[n+]([O-])ccc2c(ccnc12)-c1ccc(F)cc1F |(7.61,-4.28,;6.28,-5.06,;6.29,-6.6,;4.95,-7.38,;4.96,-8.92,;6.29,-9.68,;7.63,-8.91,;7.05,-11.01,;5.52,-11.01,;3.62,-6.61,;3.62,-5.07,;4.95,-4.3,;4.95,-2.77,;3.61,-2,;2.28,-2.76,;3.61,-.45,;4.94,.32,;6.28,-.44,;7.61,.33,;8.95,-.45,;8.95,-1.99,;7.61,-2.76,;6.28,-1.99,;7.61,1.86,;6.28,2.63,;6.28,4.16,;7.61,4.94,;7.61,6.48,;8.95,4.17,;8.95,2.63,;10.28,1.86,)|
Show InChI InChI=1S/C22H17F2N3O3S/c1-13-11-15(26-31(2,29)30)4-6-16(13)22-21-19(8-10-27(22)28)17(7-9-25-21)18-5-3-14(23)12-20(18)24/h3-12,26H,1-2H3
PDB
MMDB

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PC cid
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Similars

Article
PubMed
n/an/a 81n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibition of human p38alpha MAP kinase after 1 hr by FRET analysis


J Med Chem 54: 7899-910 (2011)


Article DOI: 10.1021/jm200975u
BindingDB Entry DOI: 10.7270/Q2MW2HKR
More data for this
Ligand-Target Pair