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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 = 'BDBM50508122'   
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))
BDBM50508122
PNG
(CHEMBL4456647)
Show SMILES CCCCc1nc(C)c(CC(=O)OC2CCCCC2)c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1noc(=O)[nH]1
Show InChI InChI=1S/C32H36N4O5/c1-3-4-14-28-33-21(2)27(19-29(37)40-24-10-6-5-7-11-24)31(38)36(28)20-22-15-17-23(18-16-22)25-12-8-9-13-26(25)30-34-32(39)41-35-30/h8-9,12-13,15-18,24H,3-7,10-11,14,19-20H2,1-2H3,(H,34,35,39)
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 1.00E+3n/an/an/an/a



Boryung Pharmaceuticals Co. Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma


Bioorg Med Chem Lett 29: 631-637 (2019)


Article DOI: 10.1016/j.bmcl.2018.12.043
BindingDB Entry DOI: 10.7270/Q22B929Z
More data for this
Ligand-Target Pair