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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 = 'BDBM50505928'   
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))		BDBM50505928
PNG
(CHEMBL4439959)
Show SMILES NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cnc(CNC(=O)c2cnn(c2N)-c2ccccc2)s1 |r|
Show InChI InChI=1S/C24H29N7O3S/c25-21-17(12-29-31(21)16-9-5-2-6-10-16)23(33)28-14-20-27-13-19(35-20)24(34)30-18(22(26)32)11-15-7-3-1-4-8-15/h2,5-6,9-10,12-13,15,18H,1,3-4,7-8,11,14,25H2,(H2,26,32)(H,28,33)(H,30,34)/t18-/m0/s1
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Article
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n/an/a 45n/an/an/an/an/an/a



Johann Wolfgang Goethe-University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His-tagged P38 alpha MAPK (1 to 360 residues) expressed in Escherichia coli incubated for 60 mins by [gamma-33P]ATP b...

J Med Chem 62: 10757-10782 (2019)


Article DOI: 10.1021/acs.jmedchem.9b01227
BindingDB Entry DOI: 10.7270/Q2NV9NJK
More data for this
Ligand-Target Pair