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BDBM50188256 2-(3-chloro-4-(4-(4-(2,4-dichlorophenoxy)butanoyl)-5-phenylisoxazol-3-yl)phenyl)acetic acid::CHEMBL215605

SMILES: OC(=O)Cc1ccc(-c2noc(c2C(=O)CCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1

InChI Key: InChIKey=VINJHESJAFNNRA-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 = 50188256   
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))
BDBM50188256
PNG
(2-(3-chloro-4-(4-(4-(2,4-dichlorophenoxy)butanoyl)...)
Show SMILES OC(=O)Cc1ccc(-c2noc(c2C(=O)CCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C27H20Cl3NO5/c28-18-9-11-23(21(30)15-18)35-12-4-7-22(32)25-26(31-36-27(25)17-5-2-1-3-6-17)19-10-8-16(13-20(19)29)14-24(33)34/h1-3,5-6,8-11,13,15H,4,7,12,14H2,(H,33,34)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
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 PPARdelta by transactivation assay


Bioorg Med Chem Lett 16: 4376-80 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.055
BindingDB Entry DOI: 10.7270/Q2V987PC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50188256
PNG
(2-(3-chloro-4-(4-(4-(2,4-dichlorophenoxy)butanoyl)...)
Show SMILES OC(=O)Cc1ccc(-c2noc(c2C(=O)CCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C27H20Cl3NO5/c28-18-9-11-23(21(30)15-18)35-12-4-7-22(32)25-26(31-36-27(25)17-5-2-1-3-6-17)19-10-8-16(13-20(19)29)14-24(33)34/h1-3,5-6,8-11,13,15H,4,7,12,14H2,(H,33,34)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at PPARgamma by transactivation assay


Bioorg Med Chem Lett 16: 4376-80 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.055
BindingDB Entry DOI: 10.7270/Q2V987PC
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50188256
PNG
(2-(3-chloro-4-(4-(4-(2,4-dichlorophenoxy)butanoyl)...)
Show SMILES OC(=O)Cc1ccc(-c2noc(c2C(=O)CCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C27H20Cl3NO5/c28-18-9-11-23(21(30)15-18)35-12-4-7-22(32)25-26(31-36-27(25)17-5-2-1-3-6-17)19-10-8-16(13-20(19)29)14-24(33)34/h1-3,5-6,8-11,13,15H,4,7,12,14H2,(H,33,34)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at PPARalpha by transactivation assay


Bioorg Med Chem Lett 16: 4376-80 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.055
BindingDB Entry DOI: 10.7270/Q2V987PC
More data for this
Ligand-Target Pair