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I will show you how to identify biological activities of every compound from SMILES, free, online website, and detail interpretation.
PASS online (PharmaExpert, Version 2.0) was used to further
investigate the studied compounds’ biological activities (Way2Drug,
2011). By using PASS online, compounds’ biological roles, mechanisms
of activity, and any potential therapeutic effects are all determined. The
PASS online predicts over 4000 different types of biological activity.
Predictions were made by looking for structure-activity relationships in
approximately 250,000 physiologically active compounds, including
prescription medicines, therapeutic candidates, hazardous chemicals,
and drug leads (Lagunin et al., 2000). Following the submission of the
chosen compounds into PASS online, the likelihood of a variety of
therapeutic effects (such as cholinergic, antioxidant, anti-inflammatory,
etc.) was evaluated using "probable activity (Pa, probability to be
active)". Pa values are expressed as a percentage of likelihood (%) and
range from 0.0001 to 1.000