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BDBM50227700 2-(2-(1-heptyl-3-(4-methoxyphenyl)ureido)-2,3-dihydro-1H-inden-5-ylthio)-2-methylpropanoic acid::CHEMBL250887

SMILES: CCCCCCCN(C1Cc2ccc(SC(C)(C)C(O)=O)cc2C1)C(=O)Nc1ccc(OC)cc1

InChI Key: InChIKey=YWDDPNCOYGCBKA-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50227700   
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 alpha


(Rattus norvegicus)
BDBM50227700
PNG
(2-(2-(1-heptyl-3-(4-methoxyphenyl)ureido)-2,3-dihy...)
Show SMILES CCCCCCCN(C1Cc2ccc(SC(C)(C)C(O)=O)cc2C1)C(=O)Nc1ccc(OC)cc1 |w:8.7|
Show InChI InChI=1S/C28H38N2O4S/c1-5-6-7-8-9-16-30(27(33)29-22-11-13-24(34-4)14-12-22)23-17-20-10-15-25(19-21(20)18-23)35-28(2,3)26(31)32/h10-15,19,23H,5-9,16-18H2,1-4H3,(H,29,33)(H,31,32)
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MMDB

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Similars

Article
PubMed
n/an/an/an/a 910n/an/an/an/a



Johnson& Johnson

Curated by ChEMBL


Assay Description
Agonist activity at rat PPARalpha in rat H4IIE cells assessed as gene induction


Bioorg Med Chem Lett 17: 6773-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.041
BindingDB Entry DOI: 10.7270/Q27945H6
More data for this
Ligand-Target Pair