Target molecule_ (pose number)

Docking score

TM165_1

−7.4

TM165_2

−7.3

Mefloquine_1

−7.3

TM165_3

−7.2

Doxycycline_4

−7.2

TM165_4

−7.0

TM165_6

−6.9

TM165_8

−6.8

TM165_9

−6.8

Doxycycline_7

−6.6

Mefloquine_4

−6.5

Artesunate_5

−6.5

Doxycycline_9

−6.5

Amodiaquine_2

−6.4

Mefloquine_7

−6.3

TM65_1

−5.9

Amodiaquine_6

−5.8

Proguanil_1

−5.8

Pyrimethamine_3

−5.7

Proguanil_2

−5.7

TM40_4

−5.5

TM40_6

−5.5

TM40_7

−5.5

TM66_1

−5.5

TM66_3

−5.5

TM81_1

−5.5

Sulfadoxine_1

−5.5

TM40_8

−5.4

TM66_4

−5.4

TM81_2

−5.4

Sulfadoxine_2

−5.4

Proguanil_4

−5.4

Proguanil_5

−5.4

TM40_9

−5.3

TM65_4

−5.3

Primaquine_3

−5.3

Primaquine_4

−5.3

Primaquine_5

−5.3