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BDBM50257361 2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-propyl]-1,2,3,4-tetrahydro-quinolin-5-yloxy}-2-methyl-propionic acid::CHEMBL448996

SMILES: CCCc1c(OCCCN2CCCc3c(OC(C)(C)C(O)=O)cccc23)ccc2cc(ccc12)C(=O)c1ccccc1

InChI Key: InChIKey=ITOWIDRWCNSSCV-UHFFFAOYSA-N

Data: 3 EC50

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 = 50257361   
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 alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50257361
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3c(OC(C)(C)C(O)=O)cccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-11-29-28-19-17-27(34(38)25-12-6-5-7-13-25)24-26(28)18-20-32(29)41-23-10-22-37-21-9-14-30-31(37)15-8-16-33(30)42-36(2,3)35(39)40/h5-8,12-13,15-20,24H,4,9-11,14,21-23H2,1-3H3,(H,39,40)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 120n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha receptor by cell based transactivation assay


J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50257361
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3c(OC(C)(C)C(O)=O)cccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-11-29-28-19-17-27(34(38)25-12-6-5-7-13-25)24-26(28)18-20-32(29)41-23-10-22-37-21-9-14-30-31(37)15-8-16-33(30)42-36(2,3)35(39)40/h5-8,12-13,15-20,24H,4,9-11,14,21-23H2,1-3H3,(H,39,40)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta receptor by cell based transactivation assay


J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50257361
PNG
(2-{1-[3-(6-Benzoyl-1-propyl-naphthalen-2-yloxy)-pr...)
Show SMILES CCCc1c(OCCCN2CCCc3c(OC(C)(C)C(O)=O)cccc23)ccc2cc(ccc12)C(=O)c1ccccc1
Show InChI InChI=1S/C36H39NO5/c1-4-11-29-28-19-17-27(34(38)25-12-6-5-7-13-25)24-26(28)18-20-32(29)41-23-10-22-37-21-9-14-30-31(37)15-8-16-33(30)42-36(2,3)35(39)40/h5-8,12-13,15-20,24H,4,9-11,14,21-23H2,1-3H3,(H,39,40)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 100n/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma receptor by cell based transactivation assay


J Med Chem 52: 2618-22 (2009)


Article DOI: 10.1021/jm801594x
BindingDB Entry DOI: 10.7270/Q2SJ1KGZ
More data for this
Ligand-Target Pair