BDBM50427882 CHEMBL2324617

SMILES: O=C(CCCCC1CCSS1)N1CCN(CCc2ccccc2)CC1

InChI Key: InChIKey=ZGTGKCMYDUMWQB-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50427882   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50427882 (CHEMBL2324617) Show SMILES O=C(CCCCC1CCSS1)N1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C20H30N2OS2/c23-20(9-5-4-8-19-11-17-24-25-19)22-15-13-21(14-16-22)12-10-18-6-2-1-3-7-18/h1-3,6-7,19H,4-5,8-17H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.40E+3	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 membrane after 150 mins by liquid scintillation counting analysis				J Med Chem 56: 2447-55 (2013) Article DOI: 10.1021/jm3017893 BindingDB Entry DOI: 10.7270/Q2KW5HDB
					More data for this Ligand-Target Pair