Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50443228'   

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
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50443228 (CHEMBL3086334) Show SMILES COc1ccc(CN2CC3CCCC2CN3Cc2ccccc2)cc1 |TLB:6:7:15.14:10.11.12,THB:16:15:8.7:10.11.12| Show InChI InChI=1S/C22H28N2O/c1-25-22-12-10-19(11-13-22)15-24-17-20-8-5-9-21(24)16-23(20)14-18-6-3-2-4-7-18/h2-4,6-7,10-13,20-21H,5,8-9,14-17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.910	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut f£r Pharmazeutische und Medizinische Chemie der Westf£lischen Wilhelms-Universit£t M£nster Curated by ChEMBL					Assay Description Binding affinity to sigma 1 receptor (unknown origin)				Eur J Med Chem 70: 78-87 (2013) Article DOI: 10.1016/j.ejmech.2013.09.021 BindingDB Entry DOI: 10.7270/Q23N24T8
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