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Table 6 WOMBAT activity classes used in the virtual screening experiments.

From: Evaluation of a Bayesian inference network for ligand-based virtual screening

Activity class Active molecules Pairwise similarity
Renin inhibitors 474 0.592 0.109
Protein kinase C inhibitors 142 0.565 0.277
Matrix metalloprotease inhibitors 694 0.444 0.148
Angiotensin II AT1 antagonists 724 0.443 0.131
HIV protease inhibitors 1128 0.442 0.146
Substance P antagonists 558 0.427 0.127
Thrombin inhibitors 421 0.418 0.144
5HT1A antagonists 592 0.399 0.134
Factor Xa inhibitors 842 0.394 0.124
5HT3 antagonists 220 0.377 0.175
Acetylcholine esterase inhibitors 503 0.373 0.155
D2 antagonists 910 0.367 0.116
Phosphodiesterase inhibitors 596 0.359 0.136
Cyclooxygenase inhibitors 965 0.324 0.139
  1. Details as for Table 3.