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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 = 'BDBM50535740'   
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))
BDBM50535740
PNG
(CHEMBL4465311)
Show SMILES CCCCc1nc(C(C)C)c(Cc2nc(no2)C(C)(C)C)c(=O)n1Cc1ccc(cc1)-c1ccccc1-c1noc(=O)[nH]1
Show InChI InChI=1S/C33H38N6O4/c1-7-8-13-26-34-28(20(2)3)25(18-27-35-31(38-42-27)33(4,5)6)30(40)39(26)19-21-14-16-22(17-15-21)23-11-9-10-12-24(23)29-36-32(41)43-37-29/h9-12,14-17,20H,7-8,13,18-19H2,1-6H3,(H,36,37,41)
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 590n/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