BDBM50045431 CHEMBL3309610

SMILES: COC1Cc2ccncc2C2(CCN(CCC(C)C)CC2)O1

InChI Key: InChIKey=SXHHRIVJZPRJCX-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 = 50045431   

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))	BDBM50045431 (CHEMBL3309610) Show SMILES COC1Cc2ccncc2C2(CCN(CCC(C)C)CC2)O1 Show InChI InChI=1S/C18H28N2O2/c1-14(2)5-9-20-10-6-18(7-11-20)16-13-19-8-4-15(16)12-17(21-3)22-18/h4,8,13-14,17H,5-7,9-12H2,1-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	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 cortex membranes				Bioorg Med Chem 22: 4277-84 (2014) Article DOI: 10.1016/j.bmc.2014.05.033 BindingDB Entry DOI: 10.7270/Q29C702R
					More data for this Ligand-Target Pair