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BDBM50384986 CHEMBL2035062

SMILES: Cc1nc(sc1C(Cc1cc(F)c(F)c(F)c1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=VRQBNZLPOKTLAT-UHFFFAOYSA-N

Data: 3 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50384986   
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))
BDBM50384986
PNG
(CHEMBL2035062)
Show SMILES Cc1nc(sc1C(Cc1cc(F)c(F)c(F)c1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H21F6NO3S2/c1-14-9-19(7-8-22(14)38-13-24(36)37)39-23(12-16-10-20(29)25(31)21(30)11-16)26-15(2)35-27(40-26)17-3-5-18(6-4-17)28(32,33)34/h3-11,23H,12-13H2,1-2H3,(H,36,37)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 6.70n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARdelta expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50384986
PNG
(CHEMBL2035062)
Show SMILES Cc1nc(sc1C(Cc1cc(F)c(F)c(F)c1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H21F6NO3S2/c1-14-9-19(7-8-22(14)38-13-24(36)37)39-23(12-16-10-20(29)25(31)21(30)11-16)26-15(2)35-27(40-26)17-3-5-18(6-4-17)28(32,33)34/h3-11,23H,12-13H2,1-2H3,(H,36,37)
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>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARgamma expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50384986
PNG
(CHEMBL2035062)
Show SMILES Cc1nc(sc1C(Cc1cc(F)c(F)c(F)c1)Sc1ccc(OCC(O)=O)c(C)c1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C28H21F6NO3S2/c1-14-9-19(7-8-22(14)38-13-24(36)37)39-23(12-16-10-20(29)25(31)21(30)11-16)26-15(2)35-27(40-26)17-3-5-18(6-4-17)28(32,33)34/h3-11,23H,12-13H2,1-2H3,(H,36,37)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Transactivation activity at human PPARalpha expressed in african green monkey CV1 cells after 24 hrs by luciferase reporter gene assay


Eur J Med Chem 53: 190-202 (2012)


Article DOI: 10.1016/j.ejmech.2012.03.055
BindingDB Entry DOI: 10.7270/Q2JW8FX2
More data for this
Ligand-Target Pair