BindingDB logo
myBDB logout

null

SMILES: CCCc1ccc(cc1)-c1oc(COc2ccc(OCC(O)=O)c(C)c2)nc1-c1cnc(OC)nc1

InChI Key: InChIKey=LXWVGOVRRHPVKU-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50312477   
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))
BDBM50312477
PNG
(2-(4-((4-(2-Methoxypyrimidin-5-yl)-5-(4-propylphen...)
Show SMILES CCCc1ccc(cc1)-c1oc(COc2ccc(OCC(O)=O)c(C)c2)nc1-c1cnc(OC)nc1
Show InChI InChI=1S/C27H27N3O6/c1-4-5-18-6-8-19(9-7-18)26-25(20-13-28-27(33-3)29-14-20)30-23(36-26)15-34-21-10-11-22(17(2)12-21)35-16-24(31)32/h6-14H,4-5,15-16H2,1-3H3,(H,31,32)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 10n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain by FRET assay


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50312477
PNG
(2-(4-((4-(2-Methoxypyrimidin-5-yl)-5-(4-propylphen...)
Show SMILES CCCc1ccc(cc1)-c1oc(COc2ccc(OCC(O)=O)c(C)c2)nc1-c1cnc(OC)nc1
Show InChI InChI=1S/C27H27N3O6/c1-4-5-18-6-8-19(9-7-18)26-25(20-13-28-27(33-3)29-14-20)30-23(36-26)15-34-21-10-11-22(17(2)12-21)35-16-24(31)32/h6-14H,4-5,15-16H2,1-3H3,(H,31,32)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

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



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Mus musculus)
BDBM50312477
PNG
(2-(4-((4-(2-Methoxypyrimidin-5-yl)-5-(4-propylphen...)
Show SMILES CCCc1ccc(cc1)-c1oc(COc2ccc(OCC(O)=O)c(C)c2)nc1-c1cnc(OC)nc1
Show InChI InChI=1S/C27H27N3O6/c1-4-5-18-6-8-19(9-7-18)26-25(20-13-28-27(33-3)29-14-20)30-23(36-26)15-34-21-10-11-22(17(2)12-21)35-16-24(31)32/h6-14H,4-5,15-16H2,1-3H3,(H,31,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 30n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at mouse PPARdelta by FRET assay


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair