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Predicting new molecular targets for known drugs.

Keiser, Michael J ; Setola, Vincent ; Irwin, John J ; Laggner, Christian ; Abbas, Atheir I ; Hufeisen, Sandra J ; Jensen, Niels H ; Kuijer, Michael B ; Matos, Roberto C ; Tran, Thuy B ; Whaley, Ryan ; Glennon, Richard A ; Hert, Jérôme ; Thomas, Kelan L H ; Edwards, Douglas D ; Shoichet, Brian K ; Roth, Bryan L Keiser, Michael J (correspondence author) ; Keiser, Michael J (record owner)

Nature, November 12, 2009, Vol.462(7270), pp.175-181 [Peer Reviewed Journal]

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Automated design of ligands to polypharmacological profiles.(RESEARCH: ARTICLE)(Report)

Besnard, Jeremy ; Ruda, Gian Filippo ; Setola, Vincent ; Abecassis, Keren ; Rodriguiz, Ramona M. ; Huang, Xi-Ping ; Norval, Suzanne ; Sassano, Maria F. ; Shin, Antony I. ; Webster, Lauren A. ; Simeons, Frederick R.C. ; Stojanovski, Laste ; Prat, Annik ; Seidah, Nabil G. ; Constam, Daniel B. ; Bickerton, G. Richard ; Read, Kevin D. ; Wetsel, William C. ; Gilbert, Ian H. ; Roth, Bryan L. ; Hopkins, Andrew L.

Nature, Dec 13, 2012, Vol.492(7428), p.215(8) [Peer Reviewed Journal]

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Chemical informatics and target identification in a zebrafish phenotypic screen.

Laggner, Christian ; Kokel, David ; Setola, Vincent ; Tolia, Alexandra ; Lin, Henry ; Irwin, John J ; Keiser, Michael J ; Cheung, Chung Yan J ; Minor, Daniel L ; Roth, Bryan L ; Peterson, Randall T ; Shoichet, Brian K Laggner, Christian (correspondence author) ; Laggner, Christian (record owner)

Nature chemical biology, December 18, 2011, Vol.8(2), pp.144-146 [Peer Reviewed Journal]

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The ketamine analogue methoxetamine and 3- and 4-methoxy analogues of phencyclidine are high affinity and selective ligands for the glutamate NMDA receptor.

Roth, Bryan L ; Gibbons, Simon ; Arunotayanun, Warunya ; Huang, Xi-Ping ; Setola, Vincent ; Treble, Ric ; Iversen, Les Roth, Bryan L (correspondence author) ; Roth, Bryan L (record owner)

PloS one, 2013, Vol.8(3), p.e59334 [Peer Reviewed Journal]

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