Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50524449'   

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 (Cavia porcellus (Guinea pig))	BDBM50524449 (CHEMBL4448336) Show SMILES Clc1ccc2oc(SCCCN3CCCCCC3)nc2c1 Show InChI InChI=1S/C16H21ClN2OS/c17-13-6-7-15-14(12-13)18-16(20-15)21-11-5-10-19-8-3-1-2-4-9-19/h6-7,12H,1-5,8-11H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Displacement of [3H]-(+)-pentazocine from sigma1 receptor in guinea pig brain membranes incubated for 150 mins by scintillation counting method				Eur J Med Chem 174: 226-235 (2019) Article DOI: 10.1016/j.ejmech.2019.04.056 BindingDB Entry DOI: 10.7270/Q2BC42ZD
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