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SMILES: Cc1cc(OCc2nc(c(o2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(nc2)N2CCOCC2)ccc1OCC(O)=O

InChI Key: InChIKey=YJQWSGKPHYWIRY-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50312479   
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))
BDBM50312479
PNG
(2-(4-((4-(6-Morpholinopyridin-3-yl)-5-(4-(trifluor...)
Show SMILES Cc1cc(OCc2nc(c(o2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(nc2)N2CCOCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C29H26F3N3O7/c1-18-14-22(7-8-23(18)40-17-26(36)37)39-16-25-34-27(20-4-9-24(33-15-20)35-10-12-38-13-11-35)28(41-25)19-2-5-21(6-3-19)42-29(30,31)32/h2-9,14-15H,10-13,16-17H2,1H3,(H,36,37)
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Article
PubMed
n/an/an/an/a 2n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARdelta ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Mus musculus)
BDBM50312479
PNG
(2-(4-((4-(6-Morpholinopyridin-3-yl)-5-(4-(trifluor...)
Show SMILES Cc1cc(OCc2nc(c(o2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(nc2)N2CCOCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C29H26F3N3O7/c1-18-14-22(7-8-23(18)40-17-26(36)37)39-16-25-34-27(20-4-9-24(33-15-20)35-10-12-38-13-11-35)28(41-25)19-2-5-21(6-3-19)42-29(30,31)32/h2-9,14-15H,10-13,16-17H2,1H3,(H,36,37)
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Article
PubMed
n/an/an/an/a 5n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at mouse PPARdelta by FRET assay


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50312479
PNG
(2-(4-((4-(6-Morpholinopyridin-3-yl)-5-(4-(trifluor...)
Show SMILES Cc1cc(OCc2nc(c(o2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(nc2)N2CCOCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C29H26F3N3O7/c1-18-14-22(7-8-23(18)40-17-26(36)37)39-16-25-34-27(20-4-9-24(33-15-20)35-10-12-38-13-11-35)28(41-25)19-2-5-21(6-3-19)42-29(30,31)32/h2-9,14-15H,10-13,16-17H2,1H3,(H,36,37)
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Article
PubMed
n/an/an/an/a 2.49E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARgamma ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50312479
PNG
(2-(4-((4-(6-Morpholinopyridin-3-yl)-5-(4-(trifluor...)
Show SMILES Cc1cc(OCc2nc(c(o2)-c2ccc(OC(F)(F)F)cc2)-c2ccc(nc2)N2CCOCC2)ccc1OCC(O)=O
Show InChI InChI=1S/C29H26F3N3O7/c1-18-14-22(7-8-23(18)40-17-26(36)37)39-16-25-34-27(20-4-9-24(33-15-20)35-10-12-38-13-11-35)28(41-25)19-2-5-21(6-3-19)42-29(30,31)32/h2-9,14-15H,10-13,16-17H2,1H3,(H,36,37)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 1.20E+3n/an/an/an/a



The Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human PPARalpha ligand binding domain expressed in human 293T cells cotransfected with Gal4-DBD by luciferase transactivation ass...


J Med Chem 53: 77-105 (2010)


Article DOI: 10.1021/jm9007399
BindingDB Entry DOI: 10.7270/Q28052RP
More data for this
Ligand-Target Pair