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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor gamma' and Ligand = 'BDBM50239187'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50239187
PNG
(CHEBI:30813 | Decanoic Acid | Decanoic Acid Anion)
Show SMILES CCCCCCCCCC(O)=O
Show InChI InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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MCE
KEGG
PC cid
PC sid
UniChem
Article
PubMed
2.20E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Binding affinity to GST-tagged PPARG LBD (unknown origin) by Fluormone Pan-PPAR Green tracer based TR-FRET assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01512
BindingDB Entry DOI: 10.7270/Q28K7DRF
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50239187
PNG
(CHEBI:30813 | Decanoic Acid | Decanoic Acid Anion)
Show SMILES CCCCCCCCCC(O)=O
Show InChI InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
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MCE
KEGG
PC cid
PC sid
UniChem
Article
n/an/a 3.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]BRL49653 from Homo sapiens (human) PPARgamma receptor by scintillation proximity assay


Citation and Details

Article DOI: 10.1007/s00044-012-0285-6
BindingDB Entry DOI: 10.7270/Q2MG7SDK
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50239187
PNG
(CHEBI:30813 | Decanoic Acid | Decanoic Acid Anion)
Show SMILES CCCCCCCCCC(O)=O
Show InChI InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 5.40E+4n/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01542
BindingDB Entry DOI: 10.7270/Q2H99983
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50239187
PNG
(CHEBI:30813 | Decanoic Acid | Decanoic Acid Anion)
Show SMILES CCCCCCCCCC(O)=O
Show InChI InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 7.60E+3n/an/an/an/a


TBA

Assay Description
Partial agonist activity at full length human PPARG expressed in African green monkey COS7 cells assessed as increase in receptor activation incubate...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01512
BindingDB Entry DOI: 10.7270/Q28K7DRF
More data for this
Ligand-Target Pair