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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 = 'BDBM50535736'   
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))
BDBM50535736
PNG
(CHEMBL4468084)
Show SMILES CCCCc1nc(C)c(Cc2nc(CCOC)no2)c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1noc(=O)[nH]1
Show InChI InChI=1S/C30H32N6O5/c1-4-5-10-26-31-19(2)24(17-27-32-25(34-40-27)15-16-39-3)29(37)36(26)18-20-11-13-21(14-12-20)22-8-6-7-9-23(22)28-33-30(38)41-35-28/h6-9,11-14H,4-5,10,15-18H2,1-3H3,(H,33,35,38)
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 4.21E+3n/an/an/an/a



Boryung Pharmaceuticals Co. Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma (unknown origin) assessed as receptor transactivation after 24 hrs by TK-PPRE-Luc expressing cells based luciferase rep...


Bioorg Med Chem Lett 29: 2275-2282 (2019)


Article DOI: 10.1016/j.bmcl.2019.06.027
BindingDB Entry DOI: 10.7270/Q2RR22RG
More data for this
Ligand-Target Pair