Table 1.

ICM scores for beauvericin (BEA) and different known inhibitors against severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) proteins.

Protein ID	Pocket ID	Drug	ICM Score (kcal/mol)
6LU7 3CL protease	A	Beauvericin	−7.24
		Chloroquine	−11.24
		Remdesivir	−14.37
		Luteolin	−13.57
		N3	−20.46
		Boceprevir	−10.4
		GC376	−20.16
		Ritonavir	−14.52
		Lopinavir	−14.35
	B	Beauvericin	−12.53
		Chloroquine	−8.04
		Remdesivir	−7.9
		Luteolin	−11.15
		N3	−2.26
		Boceprevir	−3.5
		GC376	−4.7
		Ritonavir	2.53
		Lopinavir	2.09
6VXX Spike Glycoprotein	A	Beauvericin	−9.88
		Remdesivir	−2.1
		Luteolin	−20.94
		Ivermectin	20.7
	B	Beauvericin	2.2
		Remdesivir	10.58
		Luteolin	−23.42
		Ivermectin	26.03
	Receptor binding domain spike-ACE2	Beauvericin	−1.8
		Remdesivir	−3.42
		Luteolin	−11.42
		Ivermectin	7.8
6ZSL Helicase	A	Beauvericin	−4.82
		MLS001181552	−12.24
		NPC270578	−7.7
	B	Beauvericin	−1.25
		MLS001181552	−0.5
		NPC270578	−10.5
6VWW Endoribonuclease	A	Beauvericin	−0.07
		Arzanol	−3.5
		RO-7	−1.18
		NPC169474	−10.35
	B	Beauvericin	9.35
		Arzanol	−8.211
		RO-7	−1.5
		NPC169474	−6.64
7BTF RNA-dependent-RNA-polymerase	A	Beauvericin	−3.05
		Remdesivir	−5.515
		NPC161224	−14.92
	B	Beauvericin	0.5
		Remdesivir	−1.3
		NPC161224	−15.82
6W4H Methyltransferase	A	Beauvericin	13.64
		S-adenosylmethionine	−7.28
		Sinefungin	−6.37
		NPC226294	−12
	B	Beauvericin	−3.94
		S-adenosylmethionine	−2.1
		Sinefungin	−0.7
		NPC226294	−12.04
5C8T Exoribonuclease	A	Beauvericin	2.01
		MES	−15.27
		NPC137813	−6.745
	B	Beauvericin	1.39
		MES	−14.63
		NPC137813	−11.04