BDBM50206583 CHEMBL373686::methyl (1R,2S/1S,2R)-1-phenyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]cyclopropanecarboxylate

SMILES: COC(=O)C1(CC1CN1CCN(CC1)c1ncccn1)c1ccccc1

InChI Key: InChIKey=DHUJPSZBQNBACM-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 = 50206583   

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))	BDBM50206583 (CHEMBL373686 | methyl (1R,2S/1S,2R)-1-phenyl-2-[(4...) Show SMILES COC(=O)C1(CC1CN1CCN(CC1)c1ncccn1)c1ccccc1 Show InChI InChI=1S/C20H24N4O2/c1-26-18(25)20(16-6-3-2-4-7-16)14-17(20)15-23-10-12-24(13-11-23)19-21-8-5-9-22-19/h2-9,17H,10-15H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.09E+3	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