Table 3: Score of different parameters of the pharmacophoric hypothesis.
ID |
Survival |
Site |
Vector |
Volume |
Selectivity |
Matches |
Energy |
Activity |
AAPR.51 |
3.557 |
0.78 |
0.961 |
0.816 |
1.608 |
9 |
1.018 |
1.23 |
AAPR.38 |
3.557 |
0.78 |
0.961 |
0.816 |
1.608 |
9 |
1.018 |
1.23 |
AAAP.116 |
3.512 |
0.75 |
0.958 |
0.804 |
1.481 |
9 |
1.018 |
1.23 |
AAAP.142 |
3.512 |
0.75 |
0.958 |
0.804 |
1.481 |
9 |
1.018 |
1.23 |
AAPR.6 |
3.498 |
0.77 |
0.942 |
0.791 |
1.589 |
9 |
1.045 |
1.23 |
AAPR.16 |
3.498 |
0.77 |
0.942 |
0.791 |
1.589 |
9 |
1.045 |
1.23 |
AAAP.67 |
3.491 |
0.77 |
0.94 |
0.782 |
1.466 |
9 |
1.045 |
1.23 |
AAAP.77 |
3.491 |
0.77 |
0.94 |
0.782 |
1.466 |
9 |
1.045 |
1.23 |
AAAP.79 |
3.489 |
0.77 |
0.935 |
0.782 |
1.467 |
9 |
1.25 |
0.954 |
AAAP.69 |
3.489 |
0.77 |
0.935 |
0.782 |
1.467 |
9 |
1.25 |
0.954 |
AADP.107 |
3.418 |
0.68 |
0.941 |
0.795 |
1.372 |
9 |
1.212 |
1.23 |
ADPR.56 |
3.414 |
0.69 |
0.936 |
0.784 |
1.523 |
9 |
1.212 |
1.23 |
AADP.98 |
3.414 |
0.75 |
0.894 |
0.765 |
1.366 |
9 |
1.277 |
0.954 |
AADP.96 |
3.411 |
0.72 |
0.9 |
0.787 |
1.337 |
9 |
1.195 |
1.23 |
AAAP.146 |
3.41 |
0.69 |
0.945 |
0.779 |
1.481 |
9 |
0.444 |
1.806 |
AAAP.120 |
3.41 |
0.69 |
0.945 |
0.779 |
1.481 |
9 |
0.444 |
1.806 |
AADP.129 |
3.41 |
0.7 |
0.927 |
0.785 |
1.427 |
9 |
1.518 |
1.23 |
AADP.59 |
3.41 |
0.75 |
0.898 |
0.761 |
1.448 |
9 |
1.25 |
0.954 |
ADPR.32 |
3.408 |
0.74 |
0.9 |
0.766 |
1.638 |
9 |
1.25 |
0.954 |
ADPR.46 |
3.407 |
0.74 |
0.899 |
0.769 |
1.526 |
9 |
1.277 |
0.954 |
ADPR.76 |
3.406 |
0.73 |
0.882 |
0.792 |
1.665 |
9 |
1.018 |
1.23 |
ADPR.44 |
3.403 |
0.73 |
0.899 |
0.771 |
1.527 |
9 |
1.045 |
1.23 |
AADP.108 |
3.403 |
0.71 |
0.907 |
0.781 |
1.354 |
9 |
1.418 |
0.602 |
ADPR.71 |
3.398 |
0.7 |
0.922 |
0.772 |
1.609 |
9 |
1.018 |
1.23 |
AADP.41 |
3.396 |
0.7 |
0.902 |
0.792 |
1.439 |
9 |
1.045 |
0.301 |
AADP.133 |
3.392 |
0.68 |
0.927 |
0.783 |
1.431 |
9 |
1.018 |
0.954 |
AADP.57 |
3.383 |
0.75 |
0.895 |
0.737 |
1.448 |
9 |
0.961 |
0.301 |
ADPR.5 |
3.374 |
0.71 |
0.893 |
0.767 |
1.529 |
9 |
1.443 |
1.23 |
ADPR.4 |
3.368 |
0.73 |
0.896 |
0.743 |
1.527 |
9 |
0.825 |
0.602 |
AAAP.81 |
3.355 |
0.66 |
0.927 |
0.765 |
1.481 |
9 |
0.811 |
0.602 |
AAAP.71 |
3.355 |
0.66 |
0.927 |
0.765 |
1.481 |
9 |
0.811 |
0.602 |
AAPR.20 |
3.34 |
0.67 |
0.91 |
0.758 |
1.605 |
9 |
0.811 |
0.602 |
ADPR.24 |
3.326 |
0.67 |
0.922 |
0.732 |
1.54 |
9 |
1.518 |
0.954 |
ADPR.20 |
3.325 |
0.65 |
0.904 |
0.775 |
1.612 |
9 |
1.018 |
0.301 |
AADP.51 |
3.319 |
0.66 |
0.923 |
0.733 |
1.388 |
9 |
1.045 |
0.954 |
AAPR.7 |
3.223 |
0.63 |
0.937 |
0.659 |
1.587 |
9 |
4.668 |
0.602 |
AAPR.17 |
3.223 |
0.63 |
0.937 |
0.659 |
1.587 |
9 |
4.668 |
0.602 |
AAPR.33 |
3.174 |
0.63 |
0.86 |
0.685 |
1.593 |
9 |
3.576 |
1.477 |
AAPR.30 |
3.174 |
0.63 |
0.86 |
0.685 |
1.593 |
9 |
3.576 |
1.477 |
AAPR.12 |
3.082 |
0.66 |
0.823 |
0.595 |
1.592 |
9 |
5.757 |
1.732 |