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SMILES: CN(CCCCN1[C@H](COC1=O)c1ccccc1)Cc1ccccc1

InChI Key: InChIKey=KDJNUQKPANAGAS-HXUWFJFHSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50193454   
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


(Cavia porcellus (Guinea pig))		BDBM50193454
PNG
(CHEMBL3983612)
Show SMILES CN(CCCCN1[C@H](COC1=O)c1ccccc1)Cc1ccccc1 |r|
Show InChI InChI=1S/C21H26N2O2/c1-22(16-18-10-4-2-5-11-18)14-8-9-15-23-20(17-25-21(23)24)19-12-6-3-7-13-19/h2-7,10-13,20H,8-9,14-17H2,1H3/t20-/m1/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
 25n/an/an/an/an/an/an/an/a



University of Trieste

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)-pentazocine from sigma1 receptor in guinea pig brain cortex membranes after 120 mins by scintillation counting method

Eur J Med Chem 121: 712-726 (2016)


Article DOI: 10.1016/j.ejmech.2016.06.001
BindingDB Entry DOI: 10.7270/Q2222WR9
More data for this
Ligand-Target Pair