Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 376.2 BDBM50360763

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))	BDBM50360763 (CHEMBL1934489) Show SMILES COc1ccc(cc1)-n1cnn(Cc2ccc(O)c(Br)c2)c1=O Show InChI InChI=1S/C16H14BrN3O3/c1-23-13-5-3-12(4-6-13)19-10-18-20(16(19)22)9-11-2-7-15(21)14(17)8-11/h2-8,10,21H,9H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.70E+3	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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