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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 = 'BDBM50510091'   
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))
BDBM50510091
PNG
(CHEMBL4519542)
Show SMILES CCCOc1cc(C)c2O[C@](C)(CC\C=C(/C)CC\C=C(/C)C(O)=O)CCc2c1 |r|
Show InChI InChI=1S/C25H36O4/c1-6-15-28-22-16-20(4)23-21(17-22)12-14-25(5,29-23)13-8-10-18(2)9-7-11-19(3)24(26)27/h10-11,16-17H,6-9,12-15H2,1-5H3,(H,26,27)/b18-10+,19-11+/t25-/m1/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/an/an/a 1.69E+3n/an/an/an/a



University of Valencia

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma expressed in African green monkey COS7 cells assessed as increase in receptor transcriptional activity by lucifer...


J Nat Prod 82: 1802-1812 (2019)


Article DOI: 10.1021/acs.jnatprod.9b00003
BindingDB Entry DOI: 10.7270/Q2ZW1Q7G
More data for this
Ligand-Target Pair