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. 2014 Mar 5;54(4):1050–1060. doi: 10.1021/ci500004h

Table 1. Comparison of the Experimental pKi and the Predicted pKd Values for the FDA-Approved AD Drugs.

drug target experimental Ki (nM) experimental (−pKi) HTDocking score predicted (−pKd)
tacrine acetylcholinesterase 225a 6.65 6.11
galantamine acetylcholinesterase 62b 7.21 7.18
rivastigmine acetylcholinesterase 920c 6.04 6.08
donepezil acetylcholinesterase 23d 7.64 7.25
  glutamate [NMDA] receptor subunit 3a 700e 6.15 7.17
  glutamate [NMDA] receptor subunit 3b 540f 6.27 6.33
memantine glutamate [NMDA] receptor subunit zeta-1 1200g 5.92 6.82
  glutamate [NMDA] receptor subunit epsilon 2 1020h 6.00 6.33
a

Experimental data from ref (66).

b

Experimental data from ref (67).

c

Experimental data from ref (68).

d

Experimental data from ref (69).

e

Experimental data from ref (70).

f

Experimental data from ref (71).

g

Experimental data from ref (72).

h

Experimental data from ref (73).