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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor delta' and Monomerid = 50168564   
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 delta


(Homo sapiens (Human))
BDBM50168564
PNG
(7-{3-[2-Chloro-4-(2,2,2-trifluoro-ethoxy)-phenoxy]...)
Show SMILES OC(=O)C1CCc2ccc(OCCCOc3ccc(OCC(F)(F)F)cc3Cl)cc2O1
Show InChI InChI=1S/C21H20ClF3O6/c22-16-10-14(30-12-21(23,24)25)5-7-17(16)29-9-1-8-28-15-4-2-13-3-6-18(20(26)27)31-19(13)11-15/h2,4-5,7,10-11,18H,1,3,6,8-9,12H2,(H,26,27)
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Similars

Article
PubMed
n/an/a 6.90E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against human PPARdelta


Bioorg Med Chem Lett 15: 3347-51 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.028
BindingDB Entry DOI: 10.7270/Q22N51TV
More data for this
Ligand-Target Pair