Table 2.
Top compounds from the docking studies of the ZINC database with their ZINC ID, Compound name, structure and medical use.
| ZINC ID | Compound Name | Structure | Function |
|---|---|---|---|
| ZINC000100370145 | Ecamsule | The active component of Sunscreen | |
| ZINC000169289767 | Trypan Blue | ![]() |
As dye in cataract surgery |
| ZINC000242548690 | Digoxin | ![]() |
Cardiac glycosides |
| ZINC000100378061 | Naldemedine | ![]() |
Opioid antagonist |
| ZINC000052955754 | Ergotamine | ![]() |
vasoconstrictor |
| ZINC000036701290 | Ponatinib | ![]() |
Treat chronic myeloid leukaemia |
| ZINC000012503187 | Conivaptan | ![]() |
Treatment of hyponatremia |
| ZINC000004175630 | Orap | ![]() |
anti-psychotic |
| ZINC000100018598 | Trosec | ![]() |
antispasmodic |
| ZINC0000142108876 | Eluxadoline | ![]() |
Treatment of Irritable Bowel Syndrome |
| ZINC000003927200 | Yaz | ![]() |
Oral contraceptive pill |









