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 |