Table 4.
Docking results candidate compound.
Candidate compound | PubChem CID | Binding affinity (Kcal/mol) |
---|---|---|
Brazilin a | 73384 | −9.0 |
Morindone a | 442756 | −8.7 |
Ligand cocrystal b | 139592542 | −8.4 |
Alizarin a | 6293 | −8.4 |
Gartanin a | 5281633 | −8.1 |
Mesuaxanthone a | 5281651 | −8.0 |
Methoxykaempferol a | 5377945 | −7.7 |
Gentisin a | 5281636 | −7.7 |
n-Cis-feruloyltyramine a | 6440659 | −7.7 |
Pterofuran a | 44260113 | −7.4 |
Bethanidine a | 2368 | −6.6 |
Beta phenetylamine a | 1001 | −5.1 |
a Candidate compound. bLigand cocrystal.