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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor delta' and Ligand = 'BDBM50192830'   
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 delta


(Homo sapiens (Human))
BDBM50192830
PNG
(CHEMBL3983906 | US10188627, Compound 8g)
Show SMILES CN(Cc1cc(F)ccc1OC\C=C(/C)CCC(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H26FNO5/c1-18(5-12-25(29)30)13-15-33-24-11-10-22(27)16-21(24)17-28(2)26(31)20-8-6-19(7-9-20)23-4-3-14-32-23/h3-4,6-11,13-14,16H,5,12,15,17H2,1-2H3,(H,29,30)/b18-13+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 5.5n/an/an/an/a



Temple University

Curated by ChEMBL


Assay Description
Transactivation of ProLink tagged human PPARdelta transfected in CHO-K1 cells assessed as interaction with EA labelled SRCP after 3 to 16 hrs by beta...


ACS Med Chem Lett 7: 824-5 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00301
BindingDB Entry DOI: 10.7270/Q2WH2RZ8
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50192830
PNG
(CHEMBL3983906 | US10188627, Compound 8g)
Show SMILES CN(Cc1cc(F)ccc1OC\C=C(/C)CCC(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H26FNO5/c1-18(5-12-25(29)30)13-15-33-24-11-10-22(27)16-21(24)17-28(2)26(31)20-8-6-19(7-9-20)23-4-3-14-32-23/h3-4,6-11,13-14,16H,5,12,15,17H2,1-2H3,(H,29,30)/b18-13+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/an/an/a 40n/an/an/an/a



Mitobridge, Inc.; Salk Institute for Biological Studies

US Patent


Assay Description
Cell Handling: PathHunter NHR cell lines were expanded from freezer stocks according to standard procedures. Cells were seeded in a total volume of 2...


US Patent US10188627 (2019)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50192830
PNG
(CHEMBL3983906 | US10188627, Compound 8g)
Show SMILES CN(Cc1cc(F)ccc1OC\C=C(/C)CCC(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H26FNO5/c1-18(5-12-25(29)30)13-15-33-24-11-10-22(27)16-21(24)17-28(2)26(31)20-8-6-19(7-9-20)23-4-3-14-32-23/h3-4,6-11,13-14,16H,5,12,15,17H2,1-2H3,(H,29,30)/b18-13+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/an/an/a 5.51n/an/an/an/a



Mitobridge, Inc.; Salk Institute for Biological Studies

US Patent


Assay Description
Medium including test compound was aspirated and washed with PBS. 50 μl PBS including 1 mM Mg++ and Ca++ were then added to each well. The lucif...


US Patent US10188627 (2019)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM50192830
PNG
(CHEMBL3983906 | US10188627, Compound 8g)
Show SMILES CN(Cc1cc(F)ccc1OC\C=C(/C)CCC(O)=O)C(=O)c1ccc(cc1)-c1ccco1
Show InChI InChI=1S/C26H26FNO5/c1-18(5-12-25(29)30)13-15-33-24-11-10-22(27)16-21(24)17-28(2)26(31)20-8-6-19(7-9-20)23-4-3-14-32-23/h3-4,6-11,13-14,16H,5,12,15,17H2,1-2H3,(H,29,30)/b18-13+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 40n/an/an/an/a



Temple University

Curated by ChEMBL


Assay Description
Transactivation of human Gal4-PPARdelta LBD transfected in African green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


ACS Med Chem Lett 7: 824-5 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00301
BindingDB Entry DOI: 10.7270/Q2WH2RZ8
More data for this
Ligand-Target Pair