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SMILES: CCOc1ccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(c2)C([O-])=O)cc1

InChI Key: InChIKey=NLLLBTAOCGRTOK-UHFFFAOYSA-M

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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 4 hits for monomerid = 50121419   
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))
BDBM50121419
PNG
(CHEMBL119798 | Lithium; 2-(2,4-dichloro-benzoylami...)
Show SMILES CCOc1ccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(c2)C([O-])=O)cc1
Show InChI InChI=1S/C23H19Cl2NO5/c1-2-30-16-6-3-14(4-7-16)13-31-17-8-10-21(19(12-17)23(28)29)26-22(27)18-9-5-15(24)11-20(18)25/h3-12H,2,13H2,1H3,(H,26,27)(H,28,29)/p-1
PDB
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Similars

PubMed
3.60E+3n/an/an/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
Ligand binding affinity was determined by displacement of a tritiated tracer by the unlabeled compound to a GST-PPAR fusion protein for Peroxisome pr...


Bioorg Med Chem Lett 12: 3565-7 (2002)


BindingDB Entry DOI: 10.7270/Q2Q23ZK5
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50121419
PNG
(CHEMBL119798 | Lithium; 2-(2,4-dichloro-benzoylami...)
Show SMILES CCOc1ccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(c2)C([O-])=O)cc1
Show InChI InChI=1S/C23H19Cl2NO5/c1-2-30-16-6-3-14(4-7-16)13-31-17-8-10-21(19(12-17)23(28)29)26-22(27)18-9-5-15(24)11-20(18)25/h3-12H,2,13H2,1H3,(H,26,27)(H,28,29)/p-1
PDB

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antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
Ligand binding affinity was determined by displacement of a tritiated tracer by the unlabeled compound to a GST-PPAR fusion protein for Peroxisome pr...


Bioorg Med Chem Lett 12: 3565-7 (2002)


BindingDB Entry DOI: 10.7270/Q2Q23ZK5
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50121419
PNG
(CHEMBL119798 | Lithium; 2-(2,4-dichloro-benzoylami...)
Show SMILES CCOc1ccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(c2)C([O-])=O)cc1
Show InChI InChI=1S/C23H19Cl2NO5/c1-2-30-16-6-3-14(4-7-16)13-31-17-8-10-21(19(12-17)23(28)29)26-22(27)18-9-5-15(24)11-20(18)25/h3-12H,2,13H2,1H3,(H,26,27)(H,28,29)/p-1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 700n/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
Ligand binding affinity was determined by displacement of a tritiated tracer by the unlabeled compound to a GST-PPAR fusion protein for Peroxisome pr...


Bioorg Med Chem Lett 12: 3565-7 (2002)


BindingDB Entry DOI: 10.7270/Q2Q23ZK5
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50121419
PNG
(CHEMBL119798 | Lithium; 2-(2,4-dichloro-benzoylami...)
Show SMILES CCOc1ccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(c2)C([O-])=O)cc1
Show InChI InChI=1S/C23H19Cl2NO5/c1-2-30-16-6-3-14(4-7-16)13-31-17-8-10-21(19(12-17)23(28)29)26-22(27)18-9-5-15(24)11-20(18)25/h3-12H,2,13H2,1H3,(H,26,27)(H,28,29)/p-1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
Ligand binding affinity was determined by displacement of a tritiated tracer by the unlabeled compound to a GST-PPAR fusion protein for Peroxisome pr...


Bioorg Med Chem Lett 12: 3565-7 (2002)


BindingDB Entry DOI: 10.7270/Q2Q23ZK5
More data for this
Ligand-Target Pair