BDBM50353609 CHEMBL1829570

SMILES: COC1Cc2c(cnn2-c2ccccc2)C2(CCN(Cc3ccco3)CC2)O1

InChI Key: InChIKey=ZTURMKJQUKHIJK-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 = 50353609   

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))	BDBM50353609 (CHEMBL1829570) Show SMILES COC1Cc2c(cnn2-c2ccccc2)C2(CCN(Cc3ccco3)CC2)O1 Show InChI InChI=1S/C22H25N3O3/c1-26-21-14-20-19(15-23-25(20)17-6-3-2-4-7-17)22(28-21)9-11-24(12-10-22)16-18-8-5-13-27-18/h2-8,13,15,21H,9-12,14,16H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut f£r Pharmazeutische und Medizinische Chemie der Universit£t M£nster Curated by ChEMBL					Assay Description Displacement of (+)-[3H]pentazocine from guinea pig brain sigma 1 receptor after 180 mins by scintillation counting				J Med Chem 54: 6704-13 (2011) Article DOI: 10.1021/jm200585k BindingDB Entry DOI: 10.7270/Q22R3SN0
					More data for this Ligand-Target Pair