BDBM50044057 CHEMBL107485::N-[2-(3,4-Dichloro-phenyl)-ethyl]-N'-(2-pyrrolidin-1-yl-ethyl)-ethane-1,2-diamine

SMILES: Clc1ccc(CCNCCNCCN2CCCC2)cc1Cl

InChI Key: InChIKey=PEISBNCVNNOSAK-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 = 50044057   

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 (Homo sapiens (Human))	BDBM50044057 (CHEMBL107485 | N-[2-(3,4-Dichloro-phenyl)-ethyl]-N...) Show SMILES Clc1ccc(CCNCCNCCN2CCCC2)cc1Cl Show InChI InChI=1S/C16H25Cl2N3/c17-15-4-3-14(13-16(15)18)5-6-19-7-8-20-9-12-21-10-1-2-11-21/h3-4,13,19-20H,1-2,5-12H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	54	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institutes of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Binding affinity towards sigma 1 receptor was determined in guinea pig brain membrane using [3H](+)-pentazocine as radioligand				J Med Chem 37: 314-21 (1994) BindingDB Entry DOI: 10.7270/Q20C4WFH
					More data for this Ligand-Target Pair