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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 = 'BDBM50508103'   
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))
BDBM50508103
PNG
(CHEMBL4589453)
Show SMILES CCCCOC(=O)Cc1c(C)nc(CCCC)n(Cc2ccc(cc2)-c2ccccc2-c2noc(=O)[nH]2)c1=O
Show InChI InChI=1S/C30H34N4O5/c1-4-6-12-26-31-20(3)25(18-27(35)38-17-7-5-2)29(36)34(26)19-21-13-15-22(16-14-21)23-10-8-9-11-24(23)28-32-30(37)39-33-28/h8-11,13-16H,4-7,12,17-19H2,1-3H3,(H,32,33,37)
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 2.25E+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