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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50503018   
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
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50503018
PNG
(CHEMBL4456961)
Show SMILES COc1ccccc1-c1nc([nH]c1-c1ccnc(NC(=O)C2CC2)c1)C(N)=O
Show InChI InChI=1S/C20H19N5O3/c1-28-14-5-3-2-4-13(14)17-16(24-19(25-17)18(21)26)12-8-9-22-15(10-12)23-20(27)11-6-7-11/h2-5,8-11H,6-7H2,1H3,(H2,21,26)(H,24,25)(H,22,23,27)
PDB
MMDB

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UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 265n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of GSK3beta (unknown origin) by ADP-Glo assay


ACS Med Chem Lett 10: 1407-1414 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00177
BindingDB Entry DOI: 10.7270/Q2SQ93N5
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50503018
PNG
(CHEMBL4456961)
Show SMILES COc1ccccc1-c1nc([nH]c1-c1ccnc(NC(=O)C2CC2)c1)C(N)=O
Show InChI InChI=1S/C20H19N5O3/c1-28-14-5-3-2-4-13(14)17-16(24-19(25-17)18(21)26)12-8-9-22-15(10-12)23-20(27)11-6-7-11/h2-5,8-11H,6-7H2,1H3,(H2,21,26)(H,24,25)(H,22,23,27)
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 2.35E+3n/an/an/an/an/an/a



Eberhard Karls Universit£t T£bingen

Curated by ChEMBL


Assay Description
Inhibition of P38alpha MAPK (unknown origin) by ADP-Glo assay


ACS Med Chem Lett 10: 1407-1414 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00177
BindingDB Entry DOI: 10.7270/Q2SQ93N5
More data for this
Ligand-Target Pair