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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor gamma' and Ligand = 'BDBM50169229'   
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
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50169229
PNG
((2,6-Dimethyl-4-propionyl-phenoxy)-phenyl-acetic a...)
Show SMILES CCC(=O)c1cc(C)c(OC(C(O)=O)c2ccccc2)c(C)c1
Show InChI InChI=1S/C19H20O4/c1-4-16(20)15-10-12(2)17(13(3)11-15)23-18(19(21)22)14-8-6-5-7-9-14/h5-11,18H,4H2,1-3H3,(H,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human PPAR gamma


J Med Chem 48: 4457-68 (2005)


Article DOI: 10.1021/jm0502135
BindingDB Entry DOI: 10.7270/Q2MG7P1D
More data for this
Ligand-Target Pair