Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 419.4 BDBM50545883

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 gamma (Homo sapiens (Human))	BDBM50545883 (CHEMBL4783088) Show SMILES CCOc1cc(Oc2ccc3nc(COc4cccc(c4)C(O)=O)n(C)c3c2)ccn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	182	n/a	n/a	n/a	n/a
TBA					Assay Description Agonist activity at human Gal4-DBD fused PPARgamma LBD (unknown origin) expressed in COS-7 cells incubated for 24 hrs by firefly luciferase assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.8b00645 BindingDB Entry DOI: 10.7270/Q2KH0RX8
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (Homo sapiens (Human))	BDBM50545883 (CHEMBL4783088) Show SMILES CCOc1cc(Oc2ccc3nc(COc4cccc(c4)C(O)=O)n(C)c3c2)ccn1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
TBA					Assay Description Agonist activity at human Gal4 fused PPARalpha LBD (unknown origin) expressed in COS-7 cells incubated for 24 hrs by firefly luciferase assay				Citation and Details Article DOI: 10.1021/acsmedchemlett.8b00645 BindingDB Entry DOI: 10.7270/Q2KH0RX8
					More data for this Ligand-Target Pair