Note that the compounds feature is currently in Beta, please reach out to [email protected] for assistance.
All compounds are displayed in a list view showing the molecular structure and key details about the molecule. You can click one of the molecules to view more information about that entity.
Similarity searching has been implemented returning similar molecules with a Tanimoto score about
0.7. To search by similarity prepend your query SMILES string with
s:. Search results will now display a similarity score if any results are found.
Just typing input into the search text field will yield results with similar names to your query, the results are found by fuzzy searching so results will be similar to your query. Note that this primarily searches on the compound nickname.
Updated almost 2 years ago