Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 359.4 BDBM50324134

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))	BDBM50324134 (3-tert-butyl 5-methyl 4-(4-hydroxyphenyl)-2,6-dime...) Show SMILES COC(=O)C1C(C(C(=O)OC(C)(C)C)=C(C)N=C1C)c1ccc(O)cc1 |c:16,t:13| Show InChI InChI=1S/C20H25NO5/c1-11-15(18(23)25-6)17(13-7-9-14(22)10-8-13)16(12(2)21-11)19(24)26-20(3,4)5/h7-10,15,17,22H,1-6H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.57E+3	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
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