Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 531.6 BDBM50448034

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 delta (Mus musculus)	BDBM50448034 (CHEMBL3115241) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)34(39)40)32-22-26(19-20-37(32)36-31)33(38)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARdelta expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Mus musculus)	BDBM50448034 (CHEMBL3115241) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)34(39)40)32-22-26(19-20-37(32)36-31)33(38)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.02E+3	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARgamma expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Mus musculus)	BDBM50448034 (CHEMBL3115241) Show SMILES CCCc1nn2ccc(cc2c1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(=O)NC(CC)c1ccccc1 Show InChI InChI=1S/C34H33N3O3/c1-3-10-31-29(21-23-15-17-24(18-16-23)27-13-8-9-14-28(27)34(39)40)32-22-26(19-20-37(32)36-31)33(38)35-30(4-2)25-11-6-5-7-12-25/h5-9,11-20,22,30H,3-4,10,21H2,1-2H3,(H,35,38)(H,39,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Agonist activity at mouse PPARalpha expressed in CV-1 cells by reporter gene assay				Bioorg Med Chem Lett 24: 1098-103 (2014) Article DOI: 10.1016/j.bmcl.2014.01.004 BindingDB Entry DOI: 10.7270/Q2SQ91V1
					More data for this Ligand-Target Pair