BDBM50206591 CHEMBL375499::methyl (1R,2S/1S,2R)-2-[(4-benzylpiperidin-1-yl)methyl]-1-(4-nitrophenyl)cyclopropanecarboxylate

SMILES: COC(=O)C1(CC1CN1CCC(Cc2ccccc2)CC1)c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=JJMGVDUEBPUOGG-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 = 50206591   

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))	BDBM50206591 (CHEMBL375499 | methyl (1R,2S/1S,2R)-2-[(4-benzylpi...) Show SMILES COC(=O)C1(CC1CN1CCC(Cc2ccccc2)CC1)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C24H28N2O4/c1-30-23(27)24(20-7-9-22(10-8-20)26(28)29)16-21(24)17-25-13-11-19(12-14-25)15-18-5-3-2-4-6-18/h2-10,19,21H,11-17H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.680	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Displacement of [3H](+)pentazocine from guinea pig brain sigma 1 receptor				J Med Chem 50: 951-61 (2007) Article DOI: 10.1021/jm0611197 BindingDB Entry DOI: 10.7270/Q2GH9HN8
					More data for this Ligand-Target Pair