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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 = 'BDBM50138086'   
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))
BDBM50138086
PNG
((2-{2-[4-(5-Cyano-5,5-dimethyl-pentyl)-3-oxo-3,4-d...)
Show SMILES CC(C)(CCCCN1C(=O)C(CCOc2ccccc2CC(O)=O)Oc2ccccc12)C#N
Show InChI InChI=1S/C26H30N2O5/c1-26(2,18-27)14-7-8-15-28-20-10-4-6-12-22(20)33-23(25(28)31)13-16-32-21-11-5-3-9-19(21)17-24(29)30/h3-6,9-12,23H,7-8,13-17H2,1-2H3,(H,29,30)
PDB
MMDB

NCI pathway
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 359n/an/an/an/a



Johnson and Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Agonistic activity against PPAR (peroxisome proliferator activated receptor gamma) in Suarus chinesis


J Med Chem 47: 196-209 (2003)


Article DOI: 10.1021/jm0301888
BindingDB Entry DOI: 10.7270/Q29Z9495
More data for this
Ligand-Target Pair