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Compile Data Set for Download or QSAR

Found 2 hits of ec50 for monomerid = 50168561   
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))
BDBM50168561
PNG
((R)-7-{3-[2-Chloro-4-(4,4-dimethyl-cyclohexyl)-phe...)
Show SMILES CC1(C)CCC(CC1)c1ccc(OCCCOc2ccc3CC[C@@](C)(Oc3c2)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C28H35ClO5/c1-27(2)12-9-19(10-13-27)21-6-8-24(23(29)17-21)33-16-4-15-32-22-7-5-20-11-14-28(3,26(30)31)34-25(20)18-22/h5-8,17-19H,4,9-16H2,1-3H3,(H,30,31)/t28-/m1/s1
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UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity against human PPARgamma in COS-1 cell Gal4 assay


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
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50168561
PNG
((R)-7-{3-[2-Chloro-4-(4,4-dimethyl-cyclohexyl)-phe...)
Show SMILES CC1(C)CCC(CC1)c1ccc(OCCCOc2ccc3CC[C@@](C)(Oc3c2)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C28H35ClO5/c1-27(2)12-9-19(10-13-27)21-6-8-24(23(29)17-21)33-16-4-15-32-22-7-5-20-11-14-28(3,26(30)31)34-25(20)18-22/h5-8,17-19H,4,9-16H2,1-3H3,(H,30,31)/t28-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity against human PPARalpha in COS-1 cell Gal4 assay


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