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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50524506   
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))
BDBM50524506
PNG
(CHEMBL4473730)
Show SMILES Fc1ccc(cc1)-c1nc(CCc2ccccc2)[nH]c1-c1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C26H23FN4O/c27-21-11-9-18(10-12-21)24-25(30-22(29-24)13-6-17-4-2-1-3-5-17)20-14-15-28-23(16-20)31-26(32)19-7-8-19/h1-5,9-12,14-16,19H,6-8,13H2,(H,29,30)(H,28,31,32)
PDB
MMDB

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KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of p38alpha MAPK (unknown origin) using ATF-2 as substrate after 1 hr by ELISA


Eur J Med Chem 175: 309-329 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.035
BindingDB Entry DOI: 10.7270/Q29C71T1
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50524506
PNG
(CHEMBL4473730)
Show SMILES Fc1ccc(cc1)-c1nc(CCc2ccccc2)[nH]c1-c1ccnc(NC(=O)C2CC2)c1
Show InChI InChI=1S/C26H23FN4O/c27-21-11-9-18(10-12-21)24-25(30-22(29-24)13-6-17-4-2-1-3-5-17)20-14-15-28-23(16-20)31-26(32)19-7-8-19/h1-5,9-12,14-16,19H,6-8,13H2,(H,29,30)(H,28,31,32)
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 133n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Competitive inhibition of human recombinant full length GSK3beta using YRRAAVPPSPSLSRHSSPHQ(pS)EDEEE as substrate preincubated with enzyme for 10 min...


Eur J Med Chem 175: 309-329 (2019)


Article DOI: 10.1016/j.ejmech.2019.04.035
BindingDB Entry DOI: 10.7270/Q29C71T1
More data for this
Ligand-Target Pair