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SMILES: CN(CCCOc1ccc2[C@H](CC(O)=O)CCc2c1)c1nc(ncc1C)-c1ccc(C)cc1

InChI Key: InChIKey=PRKXZISKHHPILQ-QFIPXVFZSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50200407   
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 delta


(Homo sapiens (Human))
BDBM50200407
PNG
((S)-2-(5-(3-(methyl(5-methyl-2-p-tolylpyrimidin-4-...)
Show SMILES CN(CCCOc1ccc2[C@H](CC(O)=O)CCc2c1)c1nc(ncc1C)-c1ccc(C)cc1
Show InChI InChI=1S/C27H31N3O3/c1-18-5-7-20(8-6-18)26-28-17-19(2)27(29-26)30(3)13-4-14-33-23-11-12-24-21(15-23)9-10-22(24)16-25(31)32/h5-8,11-12,15,17,22H,4,9-10,13-14,16H2,1-3H3,(H,31,32)/t22-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 9n/an/an/an/a



Bayer Pharmaceuticals Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta by FRET assay


Bioorg Med Chem Lett 17: 1056-61 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.025
BindingDB Entry DOI: 10.7270/Q2CF9PR2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Mus musculus)
BDBM50200407
PNG
((S)-2-(5-(3-(methyl(5-methyl-2-p-tolylpyrimidin-4-...)
Show SMILES CN(CCCOc1ccc2[C@H](CC(O)=O)CCc2c1)c1nc(ncc1C)-c1ccc(C)cc1
Show InChI InChI=1S/C27H31N3O3/c1-18-5-7-20(8-6-18)26-28-17-19(2)27(29-26)30(3)13-4-14-33-23-11-12-24-21(15-23)9-10-22(24)16-25(31)32/h5-8,11-12,15,17,22H,4,9-10,13-14,16H2,1-3H3,(H,31,32)/t22-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 780n/an/an/an/a



Bayer Pharmaceuticals Corporation

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma in mouse 3T3-L1 cells by IRBA


Bioorg Med Chem Lett 17: 1056-61 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.025
BindingDB Entry DOI: 10.7270/Q2CF9PR2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50200407
PNG
((S)-2-(5-(3-(methyl(5-methyl-2-p-tolylpyrimidin-4-...)
Show SMILES CN(CCCOc1ccc2[C@H](CC(O)=O)CCc2c1)c1nc(ncc1C)-c1ccc(C)cc1
Show InChI InChI=1S/C27H31N3O3/c1-18-5-7-20(8-6-18)26-28-17-19(2)27(29-26)30(3)13-4-14-33-23-11-12-24-21(15-23)9-10-22(24)16-25(31)32/h5-8,11-12,15,17,22H,4,9-10,13-14,16H2,1-3H3,(H,31,32)/t22-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.15E+3n/an/an/an/a



Bayer Pharmaceuticals Corporation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha by FRET assay


Bioorg Med Chem Lett 17: 1056-61 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.025
BindingDB Entry DOI: 10.7270/Q2CF9PR2
More data for this
Ligand-Target Pair