Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 431.2 BDBM50381577

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))	BDBM50381577 (CHEMBL2018227) Show SMILES CN(C)C(=O)c1ccc(cc1)N1C(=O)O\C(=C/c2ccc(O)c(Br)c2)C1=O Show InChI InChI=1S/C19H15BrN2O5/c1-21(2)17(24)12-4-6-13(7-5-12)22-18(25)16(27-19(22)26)10-11-3-8-15(23)14(20)9-11/h3-10,23H,1-2H3/b16-10-	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
Sumitomo Chemical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human recombinant 17-beta-HSD3 expressed in human HeLa cells using androstenedione as substrate preincubated for 30 mins prior substrat...				Bioorg Med Chem 20: 3242-54 (2012) Article DOI: 10.1016/j.bmc.2012.03.052 BindingDB Entry DOI: 10.7270/Q2RF5W2G
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