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. 2020 Dec 1;10:20974. doi: 10.1038/s41598-020-77750-3

Table 3.

Structure of newly identified virtual hits against TNF-α and their IC50 values. Data represent the mean ± SEM of triplicate determination.

S. no. Compound ID Structure of virtual hits TNF-α inhibition (IC50 µM) Cytotoxicity on NIH-3T3 cells (IC50 µM)
1 Compound 1 graphic file with name 41598_2020_77750_Figa_HTML.gif 32.5 ± 4.5 43.2 ± 0.28
2 Compound 2 graphic file with name 41598_2020_77750_Figb_HTML.gif 6.5 ± 0.8 204.04 ± 28.5
3 Compound 3 graphic file with name 41598_2020_77750_Figc_HTML.gif 27.4 ± 1.7 84.7 ± 9.2
4 Compound 4 graphic file with name 41598_2020_77750_Figd_HTML.gif 280.6 ± 9.6 95.0 ± 20.7
5 Compound 5 graphic file with name 41598_2020_77750_Fige_HTML.gif 117.7 ± 1.1 104.95 ± 1.16
6 Pentoxifylline graphic file with name 41598_2020_77750_Figf_HTML.gif 340.6 ± 7.54 -
7

Cyclohexamide

(standard drug cytotoxicity)

 – 0.46 ± 0.07