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. 2022 May 2;23(9):5054. doi: 10.3390/ijms23095054

Table 1.

Top three hits obtained after virtual screening of the ZINC database.

SN Pharmacophore Top Hits Chemical Structure Docking Score
(kcal/mol)
1. graphic file with name ijms-23-05054-i001.jpg ZINC12336992 graphic file with name ijms-23-05054-i002.jpg −9.0
2. graphic file with name ijms-23-05054-i003.jpg ZINC24751284 graphic file with name ijms-23-05054-i004.jpg −9.0
3. graphic file with name ijms-23-05054-i005.jpg ZINC58324738 graphic file with name ijms-23-05054-i006.jpg −8.9