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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 = 'BDBM50505885'   
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))
BDBM50505885
PNG
(CHEMBL4473671)
Show SMILES Cc1ccc(cc1NC(=O)c1cnn(c1)-c1ccccc1)C(=O)N[C@@H](CCC1CCCCC1)C(N)=O |r|
Show InChI InChI=1S/C28H33N5O3/c1-19-12-14-21(27(35)31-24(26(29)34)15-13-20-8-4-2-5-9-20)16-25(19)32-28(36)22-17-30-33(18-22)23-10-6-3-7-11-23/h3,6-7,10-12,14,16-18,20,24H,2,4-5,8-9,13,15H2,1H3,(H2,29,34)(H,31,35)(H,32,36)/t24-/m0/s1
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 13n/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