BDBM50246979 CHEMBL4105611::US20230331674, Table 1.1

SMILES COCCN(CC1CCCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc2ccccc2c1

InChI Key InChIKey=NIHBOOKOQZGYSF-UHFFFAOYSA-N

Data  6 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50246979   

TargetAcetylcholinesterase(Mus musculus (mouse))
University Of Ljubljana

Curated by ChEMBL
LigandPNGBDBM50246979(CHEMBL4105611 | US20230331674, Table 1.1)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of mouse AChE using acetylthiocholine iodide as substrate preincubated for 300 secs followed by substrate addition measured for 1 min by E...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMed
TargetCholinesterase(Homo sapiens (Human))
University Of Ljubljana

Curated by ChEMBL
LigandPNGBDBM50246979(CHEMBL4105611 | US20230331674, Table 1.1)
Affinity DataIC50:  4.90nMAssay Description:Inhibition of recombinant human BChE using butyrylthiocholine iodide as substrate preincubated for 300 secs followed by substrate addition measured f...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetCholinesterase(Homo sapiens (Human))
University Of Ljubljana

Curated by ChEMBL
LigandPNGBDBM50246979(CHEMBL4105611 | US20230331674, Table 1.1)
Affinity DataIC50:  4.90nMAssay Description:The inhibitory potencies against huBChE and murine AChE (mAChE) were determined for all of these synthesized compounds using the method of Ellman (El...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetAcetylcholinesterase(Mus musculus (mouse))
University Of Ljubljana

Curated by ChEMBL
LigandPNGBDBM50246979(CHEMBL4105611 | US20230331674, Table 1.1)
Affinity DataIC50: >1.00E+4nMAssay Description:Inhibition of mouse AChE using acetylthiocholine as substrate measured after 300 secs by Ellman's methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMed
TargetCholinesterase(Homo sapiens (Human))
University Of Ljubljana

Curated by ChEMBL
LigandPNGBDBM50246979(CHEMBL4105611 | US20230331674, Table 1.1)
Affinity DataIC50:  4.90nMAssay Description:Inhibition of recombinant human BChE using butyrylthiocholine as substrate measured after 300 secs by Ellman's methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
TargetCholinesterase(Homo sapiens (Human))
University Of Ljubljana

Curated by ChEMBL
LigandPNGBDBM50246979(CHEMBL4105611 | US20230331674, Table 1.1)
Affinity DataIC50:  4.90nMAssay Description:Inhibition of human recombinant BChE pre-incubated for 300 secs before substrate addition by Ellman's methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB