Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 392.2 BDBM50360764

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
17-beta-hydroxysteroid dehydrogenase type 3 (Homo sapiens (Human))	BDBM50360764 (CHEMBL1934490) Show SMILES COc1ccc(cc1)-n1c(O)c(Cc2ccc(O)c(Br)c2)oc1=O Show InChI InChI=1S/C17H14BrNO5/c1-23-12-5-3-11(4-6-12)19-16(21)15(24-17(19)22)9-10-2-7-14(20)13(18)8-10/h2-8,20-21H,9H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Chemical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human 17beta-HSD3 expressed in HeLa cells assessed as conversion of 4-androstene-3,17-dione to testosterone				Bioorg Med Chem Lett 22: 504-7 (2011) Article DOI: 10.1016/j.bmcl.2011.10.095 BindingDB Entry DOI: 10.7270/Q2BG2PFD
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