Table 1.
Molecular Docking results of ligands and TYR.
| Number | CAS | Ligands | Docking score (kcal/mol) |
|---|---|---|---|
| 1 | 16830-15-2 | Asiaticoside | −8.963 |
| 2 | 80418-24-2 | Notoginsenoside R1 | −8.386 |
| 3 | 11021-13-9 | Ginsenoside Rb2 | −8.137 |
| 4 | 20784-50-3 | Isobavachalcone | −8.02 |
| 5 | 55033-90-4 | Isorhamnetin-3-O-neohespeidoside | −8.001 |
| 6 | 123-31-9 | Benzene-1,4-diol | −7.859 |
| 7 | 1197-18-8 | Tranexamic acid | −7.813 |
| 8 | 59870-68-7 | Glabridin | −7.776 |
| 9 | 50-81-7 | Vitamin C | −7.743 |
| 10 | 21967-41-9 | Baicalin | −7.725 |
| 11 | 96574-01-5 | Salvianolic acid A | −7.714 |
| 12 | 989-51-5 | (EGCG)(-)-Epigallocatechin gallate | −7.684 |
| 13 | 458-37-7 | Curcumin | −7.668 |
| 14 | 14259-45-1 | Asperuloside | −7.656 |
| 15 | 404-86-4 | Capsaicin | −7.652 |
| 16 | 136-77-6 | Hexylresorcinol | −7.64 |
| 17 | 4046-02-0 | Ethyl ferulate | −7.523 |
| 18 | 6147-11-1 | α-Mangostin | −7.38 |
| 19 | 13241-33-3 | Neohesperidin | −7.329 |
| 20 | 486-62-4 | Ononin | -7.324 |
| 21 | 4852-22-6 | Procyanidin | -7.232 |
| 22 | 65666-07-1 | Silybin | −7.226 |
| 23 | 19879-30-2 | Bavachinin A | −7.215 |
| 24 | 7718-59-4 | Vitamin E | −7.171 |
| 25 | 2450-53-5 | Isochlorogenic acid A | −7.138 |
| 26 | 497-76-7 | Arbutin | −7.137 |
| 27 | 84650-60-2 | Tea polyphenol | −7.134 |
| 28 | 512-69-6 | Melitose | −7.133 |
| 29 | 501-30-4 | Kojic acid | −7.083 |
| 30 | 27215-14-1 | Neoandrographolide | −7.046 |