Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 435.4 BDBM50127936

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50127936 (5-{4-[3-(4-Phenoxy-phenoxy)-propoxy]-phenyl}-thiaz...) Show SMILES Oc1[nH]c(=O)sc1-c1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1 Show InChI InChI=1S/C24H21NO5S/c26-23-22(31-24(27)25-23)17-7-9-18(10-8-17)28-15-4-16-29-19-11-13-21(14-12-19)30-20-5-2-1-3-6-20/h1-3,5-14,26H,4,15-16H2,(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity against human PPAR gamma (peroxisome proliferator-activated gamma receptor)				Bioorg Med Chem Lett 13: 1801-4 (2003) BindingDB Entry DOI: 10.7270/Q2H994K2
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50127936 (5-{4-[3-(4-Phenoxy-phenoxy)-propoxy]-phenyl}-thiaz...) Show SMILES Oc1[nH]c(=O)sc1-c1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1 Show InChI InChI=1S/C24H21NO5S/c26-23-22(31-24(27)25-23)17-7-9-18(10-8-17)28-15-4-16-29-19-11-13-21(14-12-19)30-20-5-2-1-3-6-20/h1-3,5-14,26H,4,15-16H2,(H,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity against human PPAR delta (peroxisome proliferator-activated delta receptor)				Bioorg Med Chem Lett 13: 1801-4 (2003) BindingDB Entry DOI: 10.7270/Q2H994K2
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50127936 (5-{4-[3-(4-Phenoxy-phenoxy)-propoxy]-phenyl}-thiaz...) Show SMILES Oc1[nH]c(=O)sc1-c1ccc(OCCCOc2ccc(Oc3ccccc3)cc2)cc1 Show InChI InChI=1S/C24H21NO5S/c26-23-22(31-24(27)25-23)17-7-9-18(10-8-17)28-15-4-16-29-19-11-13-21(14-12-19)30-20-5-2-1-3-6-20/h1-3,5-14,26H,4,15-16H2,(H,25,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro binding affinity against human PPAR alpha (peroxisome proliferator-activated alpha receptor)				Bioorg Med Chem Lett 13: 1801-4 (2003) BindingDB Entry DOI: 10.7270/Q2H994K2
					More data for this Ligand-Target Pair