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SMILES: COc1cccc(Cn2cc(nn2)C(=O)NCCCCN2CCc3cc(OC)c(OC)cc3C2)c1

InChI Key: InChIKey=WSZZSUDEANZSAK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50016271   
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))		BDBM50016271
PNG
(CHEMBL3262522)
Show SMILES COc1cccc(Cn2cc(nn2)C(=O)NCCCCN2CCc3cc(OC)c(OC)cc3C2)c1
Show InChI InChI=1S/C26H33N5O4/c1-33-22-8-6-7-19(13-22)16-31-18-23(28-29-31)26(32)27-10-4-5-11-30-12-9-20-14-24(34-2)25(35-3)15-21(20)17-30/h6-8,13-15,18H,4-5,9-12,16-17H2,1-3H3,(H,27,32)
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Similars
Article
PubMed
 1.27E+4n/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