Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50111624'   

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))	BDBM50111624 (6-[4-((3R,5S)-3,5-Dimethyl-piperazin-1-yl)-butyl]-...) Show SMILES C[C@H]1CN(CCCCc2ccc3n(C)c(=O)sc3c2)C[C@@H](C)N1 Show InChI InChI=1S/C18H27N3OS/c1-13-11-21(12-14(2)19-13)9-5-4-6-15-7-8-16-17(10-15)23-18(22)20(16)3/h7-8,10,13-14,19H,4-6,9,11-12H2,1-3H3/t13-,14+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Université de Lille 2 Curated by ChEMBL					Assay Description In vitro binding affinity for Sigma opioid receptor by displacement of [3H]-DTG				Bioorg Med Chem Lett 12: 1149-52 (2002) BindingDB Entry DOI: 10.7270/Q2G44PM6
					More data for this Ligand-Target Pair