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BDBM50540569 CHEMBL4635727

SMILES: CC(C)(Oc1ccc(CCOc2ccc(NC(=O)Nc3ccccc3)cc2)cc1)C(=O)Nc1ccccc1

InChI Key: InChIKey=CSJLGRKBPSECCD-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50540569   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50540569
PNG
(CHEMBL4635727)
Show SMILES CC(C)(Oc1ccc(CCOc2ccc(NC(=O)Nc3ccccc3)cc2)cc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C31H31N3O4/c1-31(2,29(35)32-24-9-5-3-6-10-24)38-28-17-13-23(14-18-28)21-22-37-27-19-15-26(16-20-27)34-30(36)33-25-11-7-4-8-12-25/h3-20H,21-22H2,1-2H3,(H,32,35)(H2,33,34,36)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a 6.10E+3n/an/an/an/an/an/a



"G. d'Annunzio" University of Chieti-Pescara

Curated by ChEMBL


Assay Description
Antagonist activity at GAL4-tagged human PPARalpha LBD expressed in human HepG2 cells assessed as inhibition of Wy14,643-induced receptor transactiva...


ACS Med Chem Lett 11: 624-632 (2020)

More data for this
Ligand-Target Pair