Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 607.6 BDBM50106107

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 (Homo sapiens (Human))	BDBM50106107 (2-[3-(3-{(2-Cyclopropyl-3-[1,2,4]oxadiazol-3-yl-ph...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)Cc2ccc(cc2)C(F)(F)F)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C33H32F3N3O5/c1-32(2,31(41)42)44-25-8-3-6-21(18-25)7-5-17-39(28(40)19-22-11-15-24(16-12-22)33(34,35)36)27-10-4-9-26(29(27)23-13-14-23)30-37-20-43-38-30/h3-4,6,8-12,15-16,18,20,23H,5,7,13-14,17,19H2,1-2H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	430	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR delta chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50106107 (2-[3-(3-{(2-Cyclopropyl-3-[1,2,4]oxadiazol-3-yl-ph...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)Cc2ccc(cc2)C(F)(F)F)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C33H32F3N3O5/c1-32(2,31(41)42)44-25-8-3-6-21(18-25)7-5-17-39(28(40)19-22-11-15-24(16-12-22)33(34,35)36)27-10-4-9-26(29(27)23-13-14-23)30-37-20-43-38-30/h3-4,6,8-12,15-16,18,20,23H,5,7,13-14,17,19H2,1-2H3,(H,41,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	620	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR alpha chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50106107 (2-[3-(3-{(2-Cyclopropyl-3-[1,2,4]oxadiazol-3-yl-ph...) Show SMILES CC(C)(Oc1cccc(CCCN(C(=O)Cc2ccc(cc2)C(F)(F)F)c2cccc(-c3ncon3)c2C2CC2)c1)C(O)=O Show InChI InChI=1S/C33H32F3N3O5/c1-32(2,31(41)42)44-25-8-3-6-21(18-25)7-5-17-39(28(40)19-22-11-15-24(16-12-22)33(34,35)36)27-10-4-9-26(29(27)23-13-14-23)30-37-20-43-38-30/h3-4,6,8-12,15-16,18,20,23H,5,7,13-14,17,19H2,1-2H3,(H,41,42)	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	n/a	n/a	81	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Agonistic transcriptional activity in CV-1 cells expressing Gal4-PPAR gamma chimera				Bioorg Med Chem Lett 11: 2959-62 (2001) BindingDB Entry DOI: 10.7270/Q2V69HWQ
					More data for this Ligand-Target Pair