Identification of New Targets and the Virtual Screening of Lignans against Alzheimer’s Disease

Table 5

MoldockScore scores for the top ten lignans with the best energy values relative to the energy value of the crystallographic ligand for each protein.

ID	JNK-3	PTP1B	NQO1	PDE5	COX2	iNOS
1	-183	-177	-137	-204	-203	-178
2	-175	-156	-137	-192	-193	-153
3	-164	-154	-136	-182	-191	-147
4	-159	-153	-124	-169	-190	-144
5	-155	-153	-120	-167	-187	-143
6	-148	-152	-116	-166	-176	-143
7	-148	-152	-116	-164	-175	-143
8	-146	-151	-114	-164	-174	-141
9	-146	-151	-112	-164	-172	-139
10	-144	-150	-108	-162	-170	-139
Ligand PDB	-134	-156	-36	-139	-142	-59