BDBM50127932 5-(4-{3-[4-(4-Isobutyl-phenoxy)-2-propyl-phenoxy]-propoxy}-phenyl)-thiazolidine-2,4-dione::CHEMBL53746

SMILES: CCCc1cc(Oc2ccc(CC(C)C)cc2)ccc1OCCCOc1ccc(cc1)-c1sc(=O)[nH]c1O

InChI Key: InChIKey=DASZQHIRDZEXEH-UHFFFAOYSA-N

Data: 3 IC50  4 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 7 hits for monomerid = 50127932   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Peroxisome proliferator-activated receptor delta (Homo sapiens (Human))	BDBM50127932 (5-(4-{3-[4-(4-Isobutyl-phenoxy)-2-propyl-phenoxy]-...) Show SMILES CCCc1cc(Oc2ccc(CC(C)C)cc2)ccc1OCCCOc1ccc(cc1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C31H35NO5S/c1-4-6-24-20-27(37-26-11-7-22(8-12-26)19-21(2)3)15-16-28(24)36-18-5-17-35-25-13-9-23(10-14-25)29-30(33)32-31(34)38-29/h7-16,20-21,33H,4-6,17-19H2,1-3H3,(H,32,34)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro agonist activity tested for transactivation in human PPAR delta-GAL4 chimeric COS-1 cells				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 (PPAR alpha) (Homo sapiens (Human))	BDBM50127932 (5-(4-{3-[4-(4-Isobutyl-phenoxy)-2-propyl-phenoxy]-...) Show SMILES CCCc1cc(Oc2ccc(CC(C)C)cc2)ccc1OCCCOc1ccc(cc1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C31H35NO5S/c1-4-6-24-20-27(37-26-11-7-22(8-12-26)19-21(2)3)15-16-28(24)36-18-5-17-35-25-13-9-23(10-14-25)29-30(33)32-31(34)38-29/h7-16,20-21,33H,4-6,17-19H2,1-3H3,(H,32,34)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro agonist activity tested for transactivation in human PPAR alpha-Gal4 chimeric COS-1 cells				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 (Homo sapiens (Human))	BDBM50127932 (5-(4-{3-[4-(4-Isobutyl-phenoxy)-2-propyl-phenoxy]-...) Show SMILES CCCc1cc(Oc2ccc(CC(C)C)cc2)ccc1OCCCOc1ccc(cc1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C31H35NO5S/c1-4-6-24-20-27(37-26-11-7-22(8-12-26)19-21(2)3)15-16-28(24)36-18-5-17-35-25-13-9-23(10-14-25)29-30(33)32-31(34)38-29/h7-16,20-21,33H,4-6,17-19H2,1-3H3,(H,32,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	130	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 (Homo sapiens (Human))	BDBM50127932 (5-(4-{3-[4-(4-Isobutyl-phenoxy)-2-propyl-phenoxy]-...) Show SMILES CCCc1cc(Oc2ccc(CC(C)C)cc2)ccc1OCCCOc1ccc(cc1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C31H35NO5S/c1-4-6-24-20-27(37-26-11-7-22(8-12-26)19-21(2)3)15-16-28(24)36-18-5-17-35-25-13-9-23(10-14-25)29-30(33)32-31(34)38-29/h7-16,20-21,33H,4-6,17-19H2,1-3H3,(H,32,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	n/a	n/a	30	n/a	n/a	n/a	n/a
TBA					Assay Description Transactivation activity at Homo sapiens (human) PPARgamma				Citation and Details Article DOI: 10.1007/s00044-010-9428-9 BindingDB Entry DOI: 10.7270/Q22Z18FD
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor (Homo sapiens (Human))	BDBM50127932 (5-(4-{3-[4-(4-Isobutyl-phenoxy)-2-propyl-phenoxy]-...) Show SMILES CCCc1cc(Oc2ccc(CC(C)C)cc2)ccc1OCCCOc1ccc(cc1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C31H35NO5S/c1-4-6-24-20-27(37-26-11-7-22(8-12-26)19-21(2)3)15-16-28(24)36-18-5-17-35-25-13-9-23(10-14-25)29-30(33)32-31(34)38-29/h7-16,20-21,33H,4-6,17-19H2,1-3H3,(H,32,34)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents 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
Peroxisome proliferator-activated receptor (Homo sapiens (Human))	BDBM50127932 (5-(4-{3-[4-(4-Isobutyl-phenoxy)-2-propyl-phenoxy]-...) Show SMILES CCCc1cc(Oc2ccc(CC(C)C)cc2)ccc1OCCCOc1ccc(cc1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C31H35NO5S/c1-4-6-24-20-27(37-26-11-7-22(8-12-26)19-21(2)3)15-16-28(24)36-18-5-17-35-25-13-9-23(10-14-25)29-30(33)32-31(34)38-29/h7-16,20-21,33H,4-6,17-19H2,1-3H3,(H,32,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	30	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro agonist activity tested for transactivation in human PPAR gamma-Gal4 chimeric COS-1 cells				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))	BDBM50127932 (5-(4-{3-[4-(4-Isobutyl-phenoxy)-2-propyl-phenoxy]-...) Show SMILES CCCc1cc(Oc2ccc(CC(C)C)cc2)ccc1OCCCOc1ccc(cc1)-c1sc(=O)[nH]c1O Show InChI InChI=1S/C31H35NO5S/c1-4-6-24-20-27(37-26-11-7-22(8-12-26)19-21(2)3)15-16-28(24)36-18-5-17-35-25-13-9-23(10-14-25)29-30(33)32-31(34)38-29/h7-16,20-21,33H,4-6,17-19H2,1-3H3,(H,32,34)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents 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