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BDBM50107218 CHEMBL138932::N-(1-Benzyl-piperidin-4-yl)-2-(6-methoxy-3-oxo-indan-1-yl)-acetamide

SMILES: COc1ccc2C(=O)CC(CC(=O)NC3CCN(Cc4ccccc4)CC3)c2c1

InChI Key: InChIKey=CRPVURVPSHYFBM-UHFFFAOYNA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50107218   
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))
BDBM50107218
PNG
(CHEMBL138932 | N-(1-Benzyl-piperidin-4-yl)-2-(6-me...)
Show SMILES COc1ccc2C(=O)CC(CC(=O)NC3CCN(Cc4ccccc4)CC3)c2c1
Show InChI InChI=1/C24H28N2O3/c1-29-20-7-8-21-22(15-20)18(13-23(21)27)14-24(28)25-19-9-11-26(12-10-19)16-17-5-3-2-4-6-17/h2-8,15,18-19H,9-14,16H2,1H3,(H,25,28)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
299n/an/an/an/an/an/an/an/a



Wake Forest University School of Medicine

Curated by ChEMBL


Assay Description
Binding affinity for sigma 1 opioid receptor, measured on guinea pig brain membranes using [3H]- (+)-pentazocine as radioligand


J Med Chem 44: 4404-15 (2001)


Article DOI: 10.1021/jm010384j
BindingDB Entry DOI: 10.7270/Q2S46R7N
More data for this
Ligand-Target Pair