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. 2024 Jul 1;15:1389221. doi: 10.3389/fphar.2024.1389221

TABLE 3.

The binding energy values of core compounds of epimedium and core targets.

Target Compounds Binding affinity/(kcal/mol)
AKT1 (4GV1) Baohuoside I −4.61
Icariin −4.63
Hyperoside −5.29
Epimedin B −2.68
JUN (2P33) Baohuoside I −3.17
Icariin −1.79
Hyperoside −2.02
Epimedin B −1.45
IL6 (5SFK) Baohuoside I −3.40
Icariin −1.22
Hyperoside −1.84
Epimedin B −1.82
SRC (3SOS) Baohuoside I −4.12
Icariin −2.51
Hyperoside −2.78
Epimedin B −2.62
EGFR (3IKA) Baohuoside I −5.13
Icariin −2.84
Hyperoside −3.91
Epimedin B −1.25
BCL2 (6U64) Baohuoside I −3.34
Icariin −2.54
Hyperoside −2.18
Epimedin B −1.05