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Table 1 Docking molecular score of chalcone derivatives with MAO-A and MAO-B enzymes

From: Design of new reversible and selective inhibitors of monoamine oxidase A and a comparison with drugs already approved

Ligand

MAO-A

MAO-B

Difference

356

− 12.9

− 8.8

− 4.1

541

− 12.7

− 9.8

− 2.9

542

− 12.8

− 11.1

− 1.7

1780

− 13.3

− 11.7

− 1.6

2041

− 12.7

− 11.3

− 1.4

152

− 12.6

− 11.4

− 1.2

33

− 12.6

− 11.7

− 0.9

335

− 13

− 12.2

− 0.8

125

− 12.9

− 12.1

− 0.8

343

− 12.6

− 11.8

− 0.8

1006

− 12.8

− 12.2

− 0.6

1630

− 12.7

− 12.2

− 0.5

154

− 12.6

− 12.4

− 0.2

  1. Assays were performed using Autodock VINA software, values are affinity energy (Kcal/mol)