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BDBM50351992 CHEMBL1822599

SMILES: CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCCCCOc1cccc2C(CCCN3CCN(CC3)C3CCCCC3)CCCc12

InChI Key: InChIKey=KFHFKTDGQUMDJY-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50351992   
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))		BDBM50351992
PNG
(CHEMBL1822599)
Show SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCCCCOc1cccc2C(CCCN3CCN(CC3)C3CCCCC3)CCCc12
Show InChI InChI=1S/C41H60N4O3S/c1-43(2)39-23-11-22-38-36(39)20-13-25-41(38)49(46,47)42-26-8-3-4-9-32-48-40-24-12-19-35-33(15-10-21-37(35)40)16-14-27-44-28-30-45(31-29-44)34-17-6-5-7-18-34/h11-13,19-20,22-25,33-34,42H,3-10,14-18,21,26-32H2,1-2H3
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PC sid
UniChem

Similars
Article
PubMed
 9.08n/an/an/an/an/an/an/an/a



Universita` degli Studi di Bari Aldo Moro

Curated by ChEMBL


Assay Description
Displacement of [3H]-pentazocine from sigma 1 receptor from guinea pig brain membrane

J Med Chem 54: 5858-67 (2011)


Article DOI: 10.1021/jm200591t
BindingDB Entry DOI: 10.7270/Q2KK9C5Z
More data for this
Ligand-Target Pair