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About PAINS-Remover

PAINS (pan assay interference compounds) is likely to interfere in screening technologies via a number of means but particularly through protein reactivity. They represent poor choices for drug development and yet can furnish data that in isolation may be suggestive of a selective and optimizable hit. PAINS-Remover is designed and constructed to remove the Pan Assay Interference Compounds (PAINS) from screening libraries and for their exclusion in bioassays. This server will facility data-sharing and information exchange among UPCMLD scientific research communities with online structure search functions and data analysis tools implemented for removal of PAINS compounds.

 

To cite PAINS-Remover, please reference:
Jonathan B. Baell and Georgina A. Holloway. New Substructure Filters for Removal of Pan Assay Interference Compounds (PAINS) from Screening Libraries and for Their Exclusion in Bioassays. J. Med. Chem., 2010, 53 (7), pp 2719–2740
DOI:10.1021/jm901137j

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  • Current version Demo 0.99
 
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PAINS-Remover was created and maintained by Prof.  Xiang-Qun (Sean) Xie’s laboratory

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Any comment, suggestion or request, please send Dr. Lirong Wang an email.


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(Last updated on Nov, 2010)