Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 294.7 BDBM50365741

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

Found 2 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 alpha (Homo sapiens (Human))	BDBM50365741 (CHEMBL1956350) Show SMILES OC(=O)C(Cc1ccc(F)cc1)Oc1ccc(Cl)cc1 Show InChI InChI=1S/C15H12ClFO3/c16-11-3-7-13(8-4-11)20-14(15(18)19)9-10-1-5-12(17)6-2-10/h1-8,14H,9H2,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a
Universit£ degli Studi di Bari 'Aldo Moro' Curated by ChEMBL					Assay Description Agonist activity at GAL4-tagged human PPARalpha ligand binding domain expressed in HepG2 cells assessed as transactivation after 20 hrs by beta-galac...				Bioorg Med Chem 20: 2141-51 (2012) Article DOI: 10.1016/j.bmc.2012.01.025 BindingDB Entry DOI: 10.7270/Q2WQ0485
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50365741 (CHEMBL1956350) Show SMILES OC(=O)C(Cc1ccc(F)cc1)Oc1ccc(Cl)cc1 Show InChI InChI=1S/C15H12ClFO3/c16-11-3-7-13(8-4-11)20-14(15(18)19)9-10-1-5-12(17)6-2-10/h1-8,14H,9H2,(H,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a
Universit£ degli Studi di Bari 'Aldo Moro' Curated by ChEMBL					Assay Description Agonist activity at GAL4-tagged human PPARgamma ligand binding domain expressed in HepG2 cells assessed as transactivation after 20 hrs by beta-galac...				Bioorg Med Chem 20: 2141-51 (2012) Article DOI: 10.1016/j.bmc.2012.01.025 BindingDB Entry DOI: 10.7270/Q2WQ0485
					More data for this Ligand-Target Pair