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BDBM50272988 (E)-2-(1-(4-tert-Butoxybenzylidene)-5-fluoro-1H-inden-3-yl)ethanoicacid::CHEMBL456531

SMILES: CC(C)(C)Oc1ccc(\C=C2/C=C(CC(O)=O)c3cc(F)ccc23)cc1

InChI Key: InChIKey=CGFBDMOUJWFUTH-XNTDXEJSSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50272988   
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))
BDBM50272988
PNG
((E)-2-(1-(4-tert-Butoxybenzylidene)-5-fluoro-1H-in...)
Show SMILES CC(C)(C)Oc1ccc(\C=C2/C=C(CC(O)=O)c3cc(F)ccc23)cc1
Show InChI InChI=1S/C22H21FO3/c1-22(2,3)26-18-7-4-14(5-8-18)10-15-11-16(12-21(24)25)20-13-17(23)6-9-19(15)20/h4-11,13H,12H2,1-3H3,(H,24,25)/b15-10+
PDB
MMDB

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PC cid
PC sid
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Patents


Similars

Article
PubMed
n/an/an/an/a 1.90E+3n/an/an/an/a



Vanderbilt University Center for Structural Biology

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma expressed in human HCA7 cells assessed as induction of peroxisome proliferator response element after 12 hrs by lucifer...


J Med Chem 51: 4911-9 (2008)


Article DOI: 10.1021/jm700969c
BindingDB Entry DOI: 10.7270/Q2H70FM4
More data for this
Ligand-Target Pair