BDBM50396869 CHEMBL2170652

SMILES: COC1Cc2c(csc2C2(CCN(Cc3ccccc3)CC2)O1)-c1ccccc1

InChI Key: InChIKey=UUXBZLRYIRHKPX-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 = 50396869   

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))	BDBM50396869 (CHEMBL2170652) Show SMILES COC1Cc2c(csc2C2(CCN(Cc3ccccc3)CC2)O1)-c1ccccc1 Show InChI InChI=1S/C25H27NO2S/c1-27-23-16-21-22(20-10-6-3-7-11-20)18-29-24(21)25(28-23)12-14-26(15-13-25)17-19-8-4-2-5-9-19/h2-11,18,23H,12-17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.40	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 Displacement of [3H]-(+)-pentazocine from sigma 1 receptor in guinea pig brain membranes after 120 mins by scintillation counting				J Med Chem 55: 8047-65 (2012) Article DOI: 10.1021/jm300894h BindingDB Entry DOI: 10.7270/Q2G44RDB
					More data for this Ligand-Target Pair