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ordancat [2013/10/09 08:22] – created rkissordancat [2013/10/09 08:22] rkiss
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 **__[[ordancatsinglediv|Search for more diverse analogs of a single hit >>]]__** **__[[ordancatsinglediv|Search for more diverse analogs of a single hit >>]]__**
  
-== A) Search close analogs for a single hit == 
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-If you have a single hit and want to search and order its close analogs, follow these steps:  
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-1. Go to **[[http://mcule.com/search|"FIND CHEMICALS / SINGLE QUERY"]]** 
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-2. Specify your query (either by drawing or by providing a chemical identifier such as mcule ID, SMILES, InChI or InChIKey) 
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-3. If you want to keep a particular substructure in all resulting analogs, modify your query accordingly (delete unnecessary parts) and select **"Substructure"** search type. Note: you can block substituents at particular positions of the molecule by placing explicit hydrogen atoms. 
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-4. If you simply want the overall most similar analogs of your compound, select **"Similarity"** search type 
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-5. Click on **"SEARCH"** 
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-6. After the search was finished and the most similar compounds were displayed, click on the orange **"QUOTE"** button in the top right corner 
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-7. Fill out the quote form 
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-8. Click on either **"INSTANT QUOTE"** (quote will be generated on-the-fly - **[[https://mcule.com/pricing|subscription required]]**) or **"NEXT-DAY QUOTE"** (we will send you a quote by e-mail in 24-48 hours) 
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-**__[[usecases|Go back to use cases >>]]__** 
  
 == B) Search analogs for multiple hits by a single search == == B) Search analogs for multiple hits by a single search ==
ordancat.txt · Last modified: 2014/01/01 15:52 by flack