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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 = 'BDBM50176645'   
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))
BDBM50176645
PNG
(2-(5-(2-(5-isopropyl-2-phenyloxazol-4-yl)ethoxy)-2...)
Show SMILES CCC(C1CCc2cc(OCCc3nc(oc3C(C)C)-c3ccccc3)ccc12)C(O)=O
Show InChI InChI=1S/C27H31NO4/c1-4-21(27(29)30)23-12-10-19-16-20(11-13-22(19)23)31-15-14-24-25(17(2)3)32-26(28-24)18-8-6-5-7-9-18/h5-9,11,13,16-17,21,23H,4,10,12,14-15H2,1-3H3,(H,29,30)
PDB
MMDB

NCI pathway
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Similars

Article
PubMed
n/an/an/an/a 347n/an/an/an/a



Bayer Research Center

Curated by ChEMBL


Assay Description
Activity against PPAR gamma in human by FRET assay


Bioorg Med Chem Lett 16: 297-301 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.008
BindingDB Entry DOI: 10.7270/Q28P6025
More data for this
Ligand-Target Pair