Table 2.

Some active compounds identified by computational methods.

Compound structure	Use	Computational method	References
	Antimycobacterial agents	Virtual Screening	[89]
	SENP2 inhibitors	Virtual screening, Molecular Docking	[85]
	TASK-3 channel antagonist	Pharmacophore based virtual screening	[90]
	GAPGH inhibitor	Combinatorial docking	[91]
	Aldose reductase inhibitor	LBVS	[92]
	Ca2+ antagonist	Pharmacophore searching	[93]
	Kv1.5 channel blocker	Fragment based, de novo design	[76]
	Thrombin inhibitor	Combinatorial docking, de novo design	[94]
	Antiretroviral agent	Virtual Screening	[95]