BDBM202362 US9238626, (+/-)-(Ia) HCl

SMILES CC1=CC2CC(C1)c1c(C2)nc2cc(Cl)ccc2c1NCCCCCCCCNC(=O)c1cc(O)c2C(=O)c3c(O)cccc3C(=O)c2c1

InChI Key InChIKey=SRHFLJYMGNBGDH-UHFFFAOYSA-N

Data  4 IC50

  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 4 hits for monomerid = 202362   

TargetAcetylcholinesterase(Human)
Universitat De Barcelona

US Patent
LigandPNGBDBM202362(US9238626, (+/-)-(Ia) HCl)
Affinity DataIC50: 4.40nMpH: 8.0 T: 2°CAssay Description:AChE inhibitory activity of compounds (Ia)-(Ie) and (-)-(Ib) and (+)-(Ib) was evaluated spectrophotometrically at 25° C. by the method of Ellman ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2016
Entry Details
US Patent

TargetAcetylcholinesterase(Electric eel)
Universitat De Barcelona

US Patent
LigandPNGBDBM202362(US9238626, (+/-)-(Ia) HCl)
Affinity DataIC50: 88.6nMpH: 8.0 T: 2°CAssay Description:AChE inhibitory activity of compounds (Ia)-(Ie) and (-)-(Ib) and (+)-(Ib) was evaluated spectrophotometrically at 25° C. by the method of Ellman ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2016
Entry Details
US Patent

TargetCholinesterase(Human)
Universitat De Barcelona

US Patent
LigandPNGBDBM202362(US9238626, (+/-)-(Ia) HCl)
Affinity DataIC50: 350nMpH: 8.0 T: 2°CAssay Description:BChE inhibitory activity determinations were carried out similarly by the method of Ellman et al., using 0.02 unit/mL of human serum BChE and 300 uM ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2016
Entry Details
US Patent

TargetBeta-secretase 1(Human)
Universitat De Barcelona

US Patent
LigandPNGBDBM202362(US9238626, (+/-)-(Ia) HCl)
Affinity DataIC50: 980nMT: 2°CAssay Description:β-Secretase (BACE-1, Sigma) inhibition studies were performed by employing a peptide mimicking APP sequence as substrate (methoxycoumarin-Ser-Gl...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/21/2016
Entry Details
US Patent