Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 332.7 BDBM50324152

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

Found 1 hit 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
Mineralocorticoid receptor (Homo sapiens (Human))	BDBM50324152 (CHEMBL1215481 | Methyl 4-(2-Chlorophenyl)-5-cyano-...) Show SMILES COCC1=C(C(C(C#N)C(C)=N1)c1ccccc1Cl)C(=O)OC |c:10,t:3| Show InChI InChI=1S/C17H17ClN2O3/c1-10-12(8-19)15(11-6-4-5-7-13(11)18)16(17(21)23-3)14(20-10)9-22-2/h4-7,12,15H,9H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	655	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Antagonist activity at mineralocorticoid receptor LBD expressed in human HUH7 cells coexpressing GAL4 by luciferase reporter gene assay				J Med Chem 53: 5970-8 (2010) Article DOI: 10.1021/jm100506y BindingDB Entry DOI: 10.7270/Q2XW4KST
					More data for this Ligand-Target Pair