Table 1 Docking scores of selective antiparasitic agents for CYP51
From: Interactions of antiparasitic sterols with sterol 14α-demethylase (CYP51) of human pathogens
Antitrypanosomal agents | CYP51 | ||||
|---|---|---|---|---|---|
T. cruzi | T. brucei | M. Tuberculosis | L. infantum | H. sapiens | |
1-O-Acetylkhayanolide B | -102.7 | -106.1 | -101.2 | -107.0 | -96.5 |
20-epi-Isoiguesterinol | -101.2 | -91.9 | -79.2 | -34.7 | -88.5 |
7-Deacetylkhivorin | -101.8 | -70.0 | -114.1 | -88.2 | -44.6 |
Khivorin | -111.7 | -97.5 | -101.9 | -94.5 | -96.6 |
Physalin K | -6.4 | -112.1 | -84.6 | -94.0 | -88.7 |
Physalin V | -104.3 | -97.9 | -86.3 | -114.6 | -77.4 |
Procerin | 128.0 | -121.4 | -85.4 | -48.6 | -49.3 |
Saringosterol | -112.3 | -102.5 | -94.7 | -122.0 | -106.6 |
Taraxerol | -104.7 | -74.8 | -46.7 | -89.5 | -88.1 |
Ursolic acid | -110.9 | -79.5 | -82.7 | -102.3 | -90.2 |
α-Amyrin | -102.4 | -80.2 | 2.5 | -99.4 | -88.8 |
β-Amyrin | -104.8 | -79.5 | 5.5 | -99.0 | -78.5 |
epi -Oleanolic acid | -37.0 | -95.5 | -88.2 | -105.7 | -85.8 |
Isoiguesterin | -94.0 | -85.5 | -70.9 | -83.7 | -78.9 |