BDBM50396871 CHEMBL2170685

SMILES: COC1Cc2cc(sc2C2(CCN(Cc3ccccc3)CC2)O1)-c1cccnc1

InChI Key: InChIKey=CLCKUERXHBVZOY-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 = 50396871   

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))	BDBM50396871 (CHEMBL2170685) Show SMILES COC1Cc2cc(sc2C2(CCN(Cc3ccccc3)CC2)O1)-c1cccnc1 Show InChI InChI=1S/C24H26N2O2S/c1-27-22-15-20-14-21(19-8-5-11-25-16-19)29-23(20)24(28-22)9-12-26(13-10-24)17-18-6-3-2-4-7-18/h2-8,11,14,16,22H,9-10,12-13,15,17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.5	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