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BDBM50386199 CHEMBL2042814

SMILES: CCc1cc(F)c2ccccc2c1CNC(=O)c1c2OC3=CC(=O)C(C(C)=O)C(=O)[C@@]3(C)c2c(O)cc1OC

InChI Key: InChIKey=UZSWJCGMMXLNGV-BXFARTRRSA-N

Data: 2 EC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50386199   
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


(Homo sapiens (Human))
BDBM50386199
PNG
(CHEMBL2042814)
Show SMILES CCc1cc(F)c2ccccc2c1CNC(=O)c1c2OC3=CC(=O)C(C(C)=O)C(=O)[C@@]3(C)c2c(O)cc1OC |r,t:22|
Show InChI InChI=1S/C30H26FNO7/c1-5-15-10-19(31)17-9-7-6-8-16(17)18(15)13-32-29(37)25-22(38-4)11-21(35)26-27(25)39-23-12-20(34)24(14(2)33)28(36)30(23,26)3/h6-12,24,35H,5,13H2,1-4H3,(H,32,37)/t24?,30-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 12n/an/an/an/a



Daiichi Sankyo Co., Ltd.

Curated by ChEMBL


Assay Description
Modulation of human GAL4-fused PPARgamma LBD expressed in COS7 cells co-expressing pG5luc by luciferase reporter gene based transactivation assay


Eur J Med Chem 54: 522-33 (2012)


Article DOI: 10.1016/j.ejmech.2012.05.040
BindingDB Entry DOI: 10.7270/Q2CV4JS3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50386199
PNG
(CHEMBL2042814)
Show SMILES CCc1cc(F)c2ccccc2c1CNC(=O)c1c2OC3=CC(=O)C(C(C)=O)C(=O)[C@@]3(C)c2c(O)cc1OC |r,t:22|
Show InChI InChI=1S/C30H26FNO7/c1-5-15-10-19(31)17-9-7-6-8-16(17)18(15)13-32-29(37)25-22(38-4)11-21(35)26-27(25)39-23-12-20(34)24(14(2)33)28(36)30(23,26)3/h6-12,24,35H,5,13H2,1-4H3,(H,32,37)/t24?,30-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 0.940n/an/an/an/a



Daiichi Sankyo Co., Ltd.

Curated by ChEMBL


Assay Description
Modulation of full-length human pSG5-fused PPARgamma expressed in MG-63 cells co-expressing pGV-P2-PPRE after 24 hrs by luciferase reporter gene base...


Eur J Med Chem 54: 522-33 (2012)


Article DOI: 10.1016/j.ejmech.2012.05.040
BindingDB Entry DOI: 10.7270/Q2CV4JS3
More data for this
Ligand-Target Pair