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BDBM50396382 CHEMBL2170221

SMILES: Cc1cc(OCCCCN2CCOCC2)nn1-c1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=BJADKWSRAOXZQM-UHFFFAOYSA-N

Data: 1 KI

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50396382   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50396382
PNG
(CHEMBL2170221)
Show SMILES Cc1cc(OCCCCN2CCOCC2)nn1-c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C18H23Cl2N3O2/c1-14-12-18(21-23(14)15-4-5-16(19)17(20)13-15)25-9-3-2-6-22-7-10-24-11-8-22/h4-5,12-13H,2-3,6-11H2,1H3
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Similars

Article
PubMed
13.3n/an/an/an/an/an/an/an/a



Esteve

Curated by ChEMBL


Assay Description
Displacement of [3H](+)pentazocine from human sigma 1 receptor transfected in HEK293 cell membranes after 120 mins by scintillation counter


J Med Chem 55: 8211-24 (2012)


Article DOI: 10.1021/jm3007323
BindingDB Entry DOI: 10.7270/Q2Z89DJM
More data for this
Ligand-Target Pair