BDBM50556952 CHEMBL4754487

SMILES COc1cc(CNC(=O)CCCCCCNc2c3C4CC(Cc3nc3cc(Cl)ccc23)C=C(C)C4)ccc1O

InChI Key InChIKey=JGUYMIZRMYBDGV-UHFFFAOYSA-N

Data  2 KI  2 IC50  2 Kd

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 = 50556952   

TargetAcetylcholinesterase(Homo sapiens (Human))
University Of Barcelona

Curated by ChEMBL
LigandPNGBDBM50556952(CHEMBL4754487)
Affinity DataKi:  0.680nMAssay Description:Mixed-type inhibition of recombinant human AChE assessed as inhibition constant using acetylthiocholine iodide as substrate by Cornish-Bowden plot an...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University Of Barcelona

Curated by ChEMBL
LigandPNGBDBM50556952(CHEMBL4754487)
Affinity DataKi:  0.940nMAssay Description:Mixed-type inhibition of recombinant human AChE assessed as dissociation constant for protein-substrate-compound complex using acetylthiocholine iodi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMed
TargetAcetylcholinesterase(Electrophorus electricus (Electric eel))
University Of Barcelona

Curated by ChEMBL
LigandPNGBDBM50556952(CHEMBL4754487)
Affinity DataKd:  3.60nMAssay Description:Displacement of propidium iodide from PAS-region of electric eel AChE assessed as dissociation constant by spectrofluorimetric analysisMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMed
TargetCholinesterase(Homo sapiens (Human))
University Of Barcelona

Curated by ChEMBL
LigandPNGBDBM50556952(CHEMBL4754487)
Affinity DataIC50:  31nMAssay Description:Inhibition of human serum BChE using butyrylthiocholineiodide as substrate preincubated for 20 mins followed by substrate addition by Ellman's methodMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University Of Barcelona

Curated by ChEMBL
LigandPNGBDBM50556952(CHEMBL4754487)
Affinity DataIC50:  0.770nMAssay Description:Inhibition of recombinant human AChE using acetylthiocholineiodide as substrate preincubated for 20 mins followed by substrate addition by Ellman's m...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
University Of Barcelona

Curated by ChEMBL
LigandPNGBDBM50556952(CHEMBL4754487)
Affinity DataKd:  0.940nMAssay Description:Mixed-type inhibition of recombinant human AChE using varying concentration of acetylthiocholine iodide as substrate at 0.17 to 1.36 nM by Lineweaver...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMed