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BDBM50107208 CHEMBL138688::N-(1-Benzyl-piperidin-4-yl)-2-thiophen-2-yl-acetamide

SMILES: O=C(Cc1cccs1)NC1CCN(Cc2ccccc2)CC1

InChI Key: InChIKey=PYDAINAPBPYEQW-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50107208   
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))		BDBM50107208
PNG
(CHEMBL138688 | N-(1-Benzyl-piperidin-4-yl)-2-thiop...)
Show SMILES O=C(Cc1cccs1)NC1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C18H22N2OS/c21-18(13-17-7-4-12-22-17)19-16-8-10-20(11-9-16)14-15-5-2-1-3-6-15/h1-7,12,16H,8-11,13-14H2,(H,19,21)
PDB

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CHEMBL
PC cid
PC sid
UniChem
PubMed
 3.93n/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)


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