BDBM50038701 CHEMBL3354879

SMILES: COc1cc2CCN(CC(=O)NC3CCCc4c(OC)cccc34)Cc2cc1OC

InChI Key: InChIKey=XMRRSJYVQYHFOP-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 = 50038701   

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))	BDBM50038701 (CHEMBL3354879) Show SMILES COc1cc2CCN(CC(=O)NC3CCCc4c(OC)cccc34)Cc2cc1OC Show InChI InChI=1S/C24H30N2O4/c1-28-21-9-5-6-18-19(21)7-4-8-20(18)25-24(27)15-26-11-10-16-12-22(29-2)23(30-3)13-17(16)14-26/h5-6,9,12-13,20H,4,7-8,10-11,14-15H2,1-3H3,(H,25,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Bari ALDO MORO Curated by ChEMBL					Assay Description Displacement of [3H]-(+)-pentazocine from guinea pig brain sigma1 receptor by scintillation counting analysis				Eur J Med Chem 89: 606-15 (2014) Article DOI: 10.1016/j.ejmech.2014.10.082 BindingDB Entry DOI: 10.7270/Q2S75HZT
					More data for this Ligand-Target Pair