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BDBM50044045 CHEMBL107922::[2-({2-[(2-{[2-(3,4-Dichloro-phenyl)-ethyl]-methyl-amino}-ethyl)-methyl-amino]-ethyl}-methyl-amino)-ethyl]-methyl-(2-pyrrolidin-1-yl-ethyl)-amine

SMILES: CN(CCN(C)CCN(C)CCc1ccc(Cl)c(Cl)c1)CCN(C)CCN1CCCC1

InChI Key: InChIKey=PLIJZOIPUXTBOX-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50044045   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))		BDBM50044045
PNG
(CHEMBL107922 | [2-({2-[(2-{[2-(3,4-Dichloro-phenyl...)
Show SMILES CN(CCN(C)CCN(C)CCc1ccc(Cl)c(Cl)c1)CCN(C)CCN1CCCC1
Show InChI InChI=1S/C24H43Cl2N5/c1-27(12-9-22-7-8-23(25)24(26)21-22)13-14-28(2)15-16-29(3)17-18-30(4)19-20-31-10-5-6-11-31/h7-8,21H,5-6,9-20H2,1-4H3
PDB

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 227n/an/an/an/an/an/an/an/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