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SMILES: COC(=O)C(Cc1ccc(OCCOc2ccc3CCCNc3c2)cc1)C(O)=O

InChI Key: InChIKey=PUTUUAYFZXHMSI-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50148443   
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 gamma


(Homo sapiens (Human))
BDBM50148443
PNG
(2-{4-[2-(1,2,3,4-Tetrahydro-quinolin-7-yloxy)-etho...)
Show SMILES COC(=O)C(Cc1ccc(OCCOc2ccc3CCCNc3c2)cc1)C(O)=O
Show InChI InChI=1S/C22H25NO6/c1-27-22(26)19(21(24)25)13-15-4-7-17(8-5-15)28-11-12-29-18-9-6-16-3-2-10-23-20(16)14-18/h4-9,14,19,23H,2-3,10-13H2,1H3,(H,24,25)
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 3.80E+3n/an/an/an/a



Research Institute of Tsinghua University

Curated by ChEMBL


Assay Description
In vitro transcription activation on human peroxisome proliferator activated receptor-gamma (PPAR gamma)


Bioorg Med Chem Lett 14: 3507-11 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.053
BindingDB Entry DOI: 10.7270/Q2RF5TG1
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50148443
PNG
(2-{4-[2-(1,2,3,4-Tetrahydro-quinolin-7-yloxy)-etho...)
Show SMILES COC(=O)C(Cc1ccc(OCCOc2ccc3CCCNc3c2)cc1)C(O)=O
Show InChI InChI=1S/C22H25NO6/c1-27-22(26)19(21(24)25)13-15-4-7-17(8-5-15)28-11-12-29-18-9-6-16-3-2-10-23-20(16)14-18/h4-9,14,19,23H,2-3,10-13H2,1H3,(H,24,25)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 3.09E+3n/an/an/an/a



Research Institute of Tsinghua University

Curated by ChEMBL


Assay Description
In vitro transcription activation on human peroxisome proliferator activated receptor-delta (PPAR delta)


Bioorg Med Chem Lett 14: 3507-11 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.053
BindingDB Entry DOI: 10.7270/Q2RF5TG1
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50148443
PNG
(2-{4-[2-(1,2,3,4-Tetrahydro-quinolin-7-yloxy)-etho...)
Show SMILES COC(=O)C(Cc1ccc(OCCOc2ccc3CCCNc3c2)cc1)C(O)=O
Show InChI InChI=1S/C22H25NO6/c1-27-22(26)19(21(24)25)13-15-4-7-17(8-5-15)28-11-12-29-18-9-6-16-3-2-10-23-20(16)14-18/h4-9,14,19,23H,2-3,10-13H2,1H3,(H,24,25)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 90n/an/an/an/a



Research Institute of Tsinghua University

Curated by ChEMBL


Assay Description
In vitro transcription activation on human peroxisome proliferator activated receptor-alpha (PPAR alpha)


Bioorg Med Chem Lett 14: 3507-11 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.053
BindingDB Entry DOI: 10.7270/Q2RF5TG1
More data for this
Ligand-Target Pair