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BDBM50172881 (S)-2-[2-(Benzyl-methyl-amino)-ethyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione::CHEMBL196587

SMILES: CN(CCn1c(O)c2Cc3ccccc3Cn2c1=O)Cc1ccccc1

InChI Key: InChIKey=FBJMGSVFRGGMIH-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50172881   
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))
BDBM50172881
PNG
((S)-2-[2-(Benzyl-methyl-amino)-ethyl]-10,10a-dihyd...)
Show SMILES CN(CCn1c(O)c2Cc3ccccc3Cn2c1=O)Cc1ccccc1
Show InChI InChI=1S/C21H23N3O2/c1-22(14-16-7-3-2-4-8-16)11-12-23-20(25)19-13-17-9-5-6-10-18(17)15-24(19)21(23)26/h2-10,25H,11-15H2,1H3
PDB

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PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.5n/an/an/an/a7.5n/a



Université de Lille II

Curated by ChEMBL


Assay Description
Inhibitory activity against opioid receptor sigma 1 in guinea pig cerebral cortex using [3H]-(+)-pentazocine as radio ligand at pH 7.5 for 150 min at...


Bioorg Med Chem Lett 15: 4828-32 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.039
BindingDB Entry DOI: 10.7270/Q2TD9WW1
More data for this
Ligand-Target Pair