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BDBM50016287 CHEMBL3262784

SMILES: COc1ccccc1Cn1cc(nn1)-c1ccc(cc1)C(=O)NCCCCN1CCc2cc(OC)c(OC)cc2C1

InChI Key: InChIKey=PDMZNJVJMWVYSE-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50016287   
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))		BDBM50016287
PNG
(CHEMBL3262784)
Show SMILES COc1ccccc1Cn1cc(nn1)-c1ccc(cc1)C(=O)NCCCCN1CCc2cc(OC)c(OC)cc2C1
Show InChI InChI=1S/C32H37N5O4/c1-39-29-9-5-4-8-26(29)21-37-22-28(34-35-37)23-10-12-24(13-11-23)32(38)33-15-6-7-16-36-17-14-25-18-30(40-2)31(41-3)19-27(25)20-36/h4-5,8-13,18-19,22H,6-7,14-17,20-21H2,1-3H3,(H,33,38)
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UniChem

Similars
Article
PubMed
 8.58E+3n/an/an/an/an/an/an/an/a



Washington University School of Medicine

Curated by ChEMBL


Assay Description
Displacement of (+)-[3H]pentazocine from sigma-1 receptor in guinea pig brain membrane homogenate after 90 mins by liquid scintillation counting anal...

J Med Chem 57: 4239-51 (2014)


Article DOI: 10.1021/jm5001453
BindingDB Entry DOI: 10.7270/Q20P11KX
More data for this
Ligand-Target Pair