A focused library of 39 lamellarin-derived pyrrole alkaloids (LPAs) which processes fused type I skeleton (Schemes 1-2) were previously reported from several marine organism including molluscs, ascidians, tunicates, and sponges. For comprehensive detailed isolation, analytical and structural characterization studies, please see Fukuda et al., . Indeed, a flexible molecular docking was used to perform the virtual screening of the 39 lamellarin derivatives to find the most favourable binding interactions, and the calculated free binding energies by the set of search space coordinates, which are reported in Table for the top 10 lamellarin derivatives selected for each target along with the positive control (O6K). Table . Calculated free binding energies (∆GB, in kcal/mol) for the top 10 selected lamellarin derivatives and the positive control (O6K), for each target, as well as their reported biological activities. As can be seen in Table and