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. 2023 Mar 29;212(3):224–238. doi: 10.1093/cei/uxad037

Table 3:

Docking score of small molecule and Hub gene.

Protein DrugBank_ID Name Affinity
(kcal/mol)
ELAVL1 DB08006 N-Anthracen-2-yl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine −8.5
DB08036 6,7,12,13-Tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one −8.5
DB15308 Ridinilazole −8.5
IGF1R DB08006 N-Anthracen-2-yl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-amine −9.2
DB08036 6,7,12,13-Tetrahydro-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazol-5-one −9.6
DB15308 Ridinilazole −9.6
PARP3 DB04289 Genz-10850 −12.9
DB09074 Olaparib −12.8
DB13643 Loprazolam −12.6