null

SMILES Nc1c2CCCCc2nc2NC(=S)NC(c3cccc(Br)c3)c12

InChI Key InChIKey=RTYBGCWRXWDNEV-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50449738   

TargetAcetylcholinesterase(Homo sapiens (Human))
Laboratory of Medicinal Chemistry (IQOG, CSIC)

Curated by ChEMBL
LigandPNGBDBM50449738(CHEMBL4174958)copy SMILEScopy InChI
Affinity DataKi:  147nMAssay Description:Non-competitive inhibition of recombinant human AChE expressed in HEK293 cells assessed as enzyme-substrate-inhibitor complex using varying levels of...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WQ06BWPubMed
TargetAcetylcholinesterase(Homo sapiens (Human))
Laboratory of Medicinal Chemistry (IQOG, CSIC)

Curated by ChEMBL
LigandPNGBDBM50449738(CHEMBL4174958)copy SMILEScopy InChI
Affinity DataIC50: 37nMAssay Description:Inhibition of recombinant human AChE expressed in HEK293 cells using acetylthiocholine as substrate pretreated for 20 mins followed by substrate addi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WQ06BWPubMed
TargetCholinesterase(Homo sapiens (Human))
Laboratory of Medicinal Chemistry (IQOG, CSIC)

Curated by ChEMBL
LigandPNGBDBM50449738(CHEMBL4174958)copy SMILEScopy InChI
Affinity DataIC50: 1.27E+3nMAssay Description:Inhibition of recombinant human serum BChE using butyrylthiocholine as substrate pretreated for 20 mins followed by substrate addition by Ellman's me...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2WQ06BWPubMed