Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 353.3 BDBM50305340

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))	BDBM50305340 (7-hydroxy-3-((pyridin-2-ylthio)methyl)-4-(trifluor...) Show SMILES Oc1ccc2c(c(CSc3ccccn3)c(=O)oc2c1)C(F)(F)F Show InChI InChI=1S/C16H10F3NO3S/c17-16(18,19)14-10-5-4-9(21)7-12(10)23-15(22)11(14)8-24-13-3-1-2-6-20-13/h1-7,21H,8H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	320	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				Bioorg Med Chem Lett 20: 272-5 (2010) Article DOI: 10.1016/j.bmcl.2009.10.111 BindingDB Entry DOI: 10.7270/Q2SF2W8B
					More data for this Ligand-Target Pair