How to: Find bioassays in which a given drug is active
Starting with...
A DRUG NAME
-
Search for the drug name in PubChem Compound home page.
-
Click on the number next to BioAssays: Active under Bioactivity Experiments on the right panel.
A PUBCHEM SID (SUBSTANCE ID) OR CID (COMPOUND ID) FOR THE DRUG
-
Search for the SID or CID in PubChem Substance or PubChem Compound.
-
Continue with step 2 under "a drug name" above.
A MOLECULAR FORMULA
-
Go to the PubChem Structure Search page.
-
Click on the "Molecular Formula" heading.
-
Enter the molecular formula in the search box and click the Search button. (Molecular formulas are case-sensitive. E.g. C6H11O6Cl)
-
Continue with step 2 under "a drug name" above.
A SMILES STRING FOR THE DRUG
-
Go to the PubChem Structure Search page.
-
Click the "Identity/Similarity" heading.
-
Enter the SMILES string in the input box and click the Search button.
-
Continue with step 2 under "a drug name" above.