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1 similar compounds to monomer 28681

Compile data set for download or QSAR
Wt: 371.4
BDBM50166291

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50166291   
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))
BDBM50166291
PNG
(3-Methyl-5-{4-[2-(methyl-pyridin-2-yl-amino)-ethox...)
Show SMILES CN(CCOc1ccc(Cc2sc(=O)n(C)c2O)cc1)c1ccccn1
Show InChI InChI=1S/C19H21N3O3S/c1-21(17-5-3-4-10-20-17)11-12-25-15-8-6-14(7-9-15)13-16-18(23)22(2)19(24)26-16/h3-10,23H,11-13H2,1-2H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human peroxisome proliferator activated receptor gamma binding


Bioorg Med Chem Lett 15: 2437-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.092
BindingDB Entry DOI: 10.7270/Q2CF9PM8
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50166291
PNG
(3-Methyl-5-{4-[2-(methyl-pyridin-2-yl-amino)-ethox...)
Show SMILES CN(CCOc1ccc(Cc2sc(=O)n(C)c2O)cc1)c1ccccn1
Show InChI InChI=1S/C19H21N3O3S/c1-21(17-5-3-4-10-20-17)11-12-25-15-8-6-14(7-9-15)13-16-18(23)22(2)19(24)26-16/h3-10,23H,11-13H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a>3.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Maximal intrinsic response against peroxisome proliferator activated receptor gamma transactivation


Bioorg Med Chem Lett 15: 2437-40 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.092
BindingDB Entry DOI: 10.7270/Q2CF9PM8
More data for this
Ligand-Target Pair