Skip to main content
. 2022 Oct 5;13:986931. doi: 10.3389/fphar.2022.986931

TABLE 5.

Free binding energies of AKT1, PPARG, GSK3β and ADORA1 with their corresponding active compounds.

Target Compound Free binding energy (kcal/mol)
AKT1 MLF24 −8.51
MLF42 −8.05
MLF8 −7.59
MLF55 −7.47
MLF7 −7.37
MLF23 −6.89
PPARG MLF24 −8.99
GSK3β MLF42 −8.44
MLF55 −7.71
MLF8 −7.6
MLF7 −7.37
MLF23 −7.36
MLF51 −7.36
MLF54 −7.12
ADORA1 MLF4 −9.31
MLF24 −8.12
MLF54 −7.53
MLF55 −7.25
MLF8 −6.89
MLF51 −6.80
MLF23 −6.72
MLF7 −6.37