Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond

A major cause of the paucity of new starting points for drug discovery is the lack of interaction between academia and industry. Much of the global resource in biology is present in universities, whereas the focus of medicinal chemistry is still largely within industry. Open source drug discovery, w...

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Main Authors: Phillips, Margaret A., Van Voorhis, Wesley C., Adams, John H., Adelfio, Roberto, Ahyong, Vida, Akabas, Myles H., Alano, Pietro, Alday, Aintzane, Alemán Resto, Yesmalie, Alsibaee, Aishah, Alzualde, Ainhoa, Andrews, Katherine T., Avery, Simon V., Avery, Vicky M., Ayong, Lawrence, Baker, Mark, Baker, Stephen, Ben Mamoun, Choukri, Bhatia, Sangeeta, Bickle, Quentin, Bounaadja, Lotfi, Bowling, Tana, Bosch, Jürgen, Boucher, Lauren E., Boyom, Fabrice F., Brea, Jose, Brennan, Marian, Burton, Audrey, Caffrey, Conor R., Camarda, Grazia, Carrasquilla, Manuela, Carter, Dee, Belen Cassera, Maria, Chih-Chien Cheng, Ken, Chindaudomsate, Worathad, Chubb, Anthony, Colon, Beatrice L., Colón-López, Daisy D., Corbett, Yolanda, Crowther, Gregory J., Cowan, Noemi, D’Alessandro, Sarah, Le Dang, Na, Delves, Michael, DeRisi, Joseph L., Du, Alan Y., Duffy, Sandra, Abd El-Salam El-Sayed, Shimaa, Ferdig, Michael T., Fernández Robledo, José A., Fidock, David A., Florent, Isabelle, Fokou, Patrick V. T., Galstian, Ani, Gamo, Francisco Javier, Gokool, Suzanne, Gold, Ben, Golub, Todd, Goldgof, Gregory M., Guha, Rajarshi, Guiguemde, W. Armand, Gural, Nil, Guy, R. Kiplin, Hansen, Michael A. E., Hanson, Kirsten K., Hemphill, Andrew, Hooft van Huijsduijnen, Rob, Horii, Takaaki, Horrocks, Paul, Hughes, Tyler B., Huston, Christopher, Igarashi, Ikuo, Ingram-Sieber, Katrin, Itoe, Maurice A., Jadhav, Ajit, Naranuntarat Jensen, Amornrat, Jensen, Laran T., Jiang, Rays H.Y., Kaiser, Annette, Keiser, Jennifer, Ketas, Thomas, Kicka, Sebastien, Kim, Sunyoung, Kirk, Kiaran, Kumar, Vidya P., Kyle, Dennis E., Lafuente, Maria Jose, Landfear, Scott, Lee, Nathan, Lee, Sukjun, Lehane, Adele M., Li, Fengwu, Little, David, Liu, Liqiong, Llinás, Manuel, Loza, Maria I., Lubar, Aristea, Lucantoni, Leonardo, Lucet, Isabelle, Maes, Louis, Mancama, Dalu, Mansour, Nuha R., March, Sandra, McGowan, Sheena, Medina Vera, Iset, Meister, Stephan, Mercer, Luke, Mestres, Jordi, Mfopa, Alvine N., Misra, Raj N., Moon, Seunghyun, Moore, John P., Morais Rodrigues da Costa, Francielly, Müller, Joachim, Muriana, Arantza, Nakazawa Hewitt, Stephen, Nare, Bakela, Nathan, Carl, Narraidoo, Nathalie, Nawaratna, Sujeevi, Ojo, Kayode K., Ortiz, Diana, Panic, Gordana, Papadatos, George, Parapini, Silvia, Patra, Kailash, Pham, Ngoc, Prats, Sarah, Plouffe, David M., Poulsen, Sally-Ann, Pradhan, Anupam, Quevedo, Celia, Quinn, Ronald J., Rice, Christopher A., Abdo Rizk, Mohamed, Ruecker, Andrea, St. Onge, Robert, Salgado Ferreira, Rafaela, Samra, Jasmeet, Robinett, Natalie G., Schlecht, Ulrich, Schmitt, Marjorie, Silva Villela, Filipe, Silvestrini, Francesco, Sinden, Robert, Smith, Dennis A., Soldati, Thierry, Spitzmüller, Andreas, Stamm, Serge Maximilian, Sullivan, David J., Sullivan, William, Suresh, Sundari, Suzuki, Brian M., Suzuki, Yo, Swamidass, S. Joshua, Taramelli, Donatella, Tchokouaha, Lauve R.Y., Theron, Anjo, Thomas, David, Tonissen, Kathryn F., Townson, Simon, Tripathi, Abhai K., Trofimov, Valentin, Udenze, Kenneth O., Ullah, Imran, Vallieres, Cindy, Vigil, Edgar, Vinetz, Joseph M., Voong Vinh, Phat, Vu, Hoan, Watanabe, Nao-aki, Weatherby, Kate, White, Pamela M., Wilks, Andrew F., Winzeler, Elizabeth A., Wojcik, Edward, Wree, Melanie, Wu, Wesley, Yokoyama, Naoaki, Zollo, Paul H. A., Abla, Nada, Blasco, Benjamin, Burrows, Jeremy, Laleu, Benoît, Leroy, Didier, Spangenberg, Thomas, Wells, Timothy, Willis, Paul A.
Format: Article
Published: Public Library of Science 2016
Online Access:https://eprints.nottingham.ac.uk/37733/
_version_ 1848795522111897600
author Phillips, Margaret A.
Van Voorhis, Wesley C.
Adams, John H.
Adelfio, Roberto
Ahyong, Vida
Akabas, Myles H.
Alano, Pietro
Alday, Aintzane
Alemán Resto, Yesmalie
Alsibaee, Aishah
Alzualde, Ainhoa
Andrews, Katherine T.
Avery, Simon V.
Avery, Vicky M.
Ayong, Lawrence
Baker, Mark
Baker, Stephen
Ben Mamoun, Choukri
Bhatia, Sangeeta
Bickle, Quentin
Bounaadja, Lotfi
Bowling, Tana
Bosch, Jürgen
Boucher, Lauren E.
Boyom, Fabrice F.
Brea, Jose
Brennan, Marian
Burton, Audrey
Caffrey, Conor R.
Camarda, Grazia
Carrasquilla, Manuela
Carter, Dee
Belen Cassera, Maria
Chih-Chien Cheng, Ken
Chindaudomsate, Worathad
Chubb, Anthony
Colon, Beatrice L.
Colón-López, Daisy D.
Corbett, Yolanda
Crowther, Gregory J.
Cowan, Noemi
D’Alessandro, Sarah
Le Dang, Na
Delves, Michael
DeRisi, Joseph L.
Du, Alan Y.
Duffy, Sandra
Abd El-Salam El-Sayed, Shimaa
Ferdig, Michael T.
Fernández Robledo, José A.
Fidock, David A.
Florent, Isabelle
Fokou, Patrick V. T.
Galstian, Ani
Gamo, Francisco Javier
Gokool, Suzanne
Gold, Ben
Golub, Todd
Goldgof, Gregory M.
Guha, Rajarshi
Guiguemde, W. Armand
Gural, Nil
Guy, R. Kiplin
Hansen, Michael A. E.
Hanson, Kirsten K.
Hemphill, Andrew
Hooft van Huijsduijnen, Rob
Horii, Takaaki
Horrocks, Paul
Hughes, Tyler B.
Huston, Christopher
Igarashi, Ikuo
Ingram-Sieber, Katrin
Itoe, Maurice A.
Jadhav, Ajit
Naranuntarat Jensen, Amornrat
Jensen, Laran T.
Jiang, Rays H.Y.
Kaiser, Annette
Keiser, Jennifer
Ketas, Thomas
Kicka, Sebastien
Kim, Sunyoung
Kirk, Kiaran
Kumar, Vidya P.
Kyle, Dennis E.
Lafuente, Maria Jose
Landfear, Scott
Lee, Nathan
Lee, Sukjun
Lehane, Adele M.
Li, Fengwu
Little, David
Liu, Liqiong
Llinás, Manuel
Loza, Maria I.
Lubar, Aristea
Lucantoni, Leonardo
Lucet, Isabelle
Maes, Louis
Mancama, Dalu
Mansour, Nuha R.
March, Sandra
McGowan, Sheena
Medina Vera, Iset
Meister, Stephan
Mercer, Luke
Mestres, Jordi
Mfopa, Alvine N.
Misra, Raj N.
Moon, Seunghyun
Moore, John P.
Morais Rodrigues da Costa, Francielly
Müller, Joachim
Muriana, Arantza
Nakazawa Hewitt, Stephen
Nare, Bakela
Nathan, Carl
Narraidoo, Nathalie
Nawaratna, Sujeevi
Ojo, Kayode K.
Ortiz, Diana
Panic, Gordana
Papadatos, George
Parapini, Silvia
Patra, Kailash
Pham, Ngoc
Prats, Sarah
Plouffe, David M.
Poulsen, Sally-Ann
Pradhan, Anupam
Quevedo, Celia
Quinn, Ronald J.
Rice, Christopher A.
Abdo Rizk, Mohamed
Ruecker, Andrea
St. Onge, Robert
Salgado Ferreira, Rafaela
Samra, Jasmeet
Robinett, Natalie G.
Schlecht, Ulrich
Schmitt, Marjorie
Silva Villela, Filipe
Silvestrini, Francesco
Sinden, Robert
Smith, Dennis A.
Soldati, Thierry
Spitzmüller, Andreas
Stamm, Serge Maximilian
Sullivan, David J.
Sullivan, William
Suresh, Sundari
Suzuki, Brian M.
Suzuki, Yo
Swamidass, S. Joshua
Taramelli, Donatella
Tchokouaha, Lauve R.Y.
Theron, Anjo
Thomas, David
Tonissen, Kathryn F.
Townson, Simon
Tripathi, Abhai K.
Trofimov, Valentin
Udenze, Kenneth O.
Ullah, Imran
Vallieres, Cindy
Vigil, Edgar
Vinetz, Joseph M.
Voong Vinh, Phat
Vu, Hoan
Watanabe, Nao-aki
Weatherby, Kate
White, Pamela M.
Wilks, Andrew F.
Winzeler, Elizabeth A.
Wojcik, Edward
Wree, Melanie
Wu, Wesley
Yokoyama, Naoaki
Zollo, Paul H. A.
Abla, Nada
Blasco, Benjamin
Burrows, Jeremy
Laleu, Benoît
Leroy, Didier
Spangenberg, Thomas
Wells, Timothy
Willis, Paul A.
author_facet Phillips, Margaret A.
Van Voorhis, Wesley C.
Adams, John H.
Adelfio, Roberto
Ahyong, Vida
Akabas, Myles H.
Alano, Pietro
Alday, Aintzane
Alemán Resto, Yesmalie
Alsibaee, Aishah
Alzualde, Ainhoa
Andrews, Katherine T.
Avery, Simon V.
Avery, Vicky M.
Ayong, Lawrence
Baker, Mark
Baker, Stephen
Ben Mamoun, Choukri
Bhatia, Sangeeta
Bickle, Quentin
Bounaadja, Lotfi
Bowling, Tana
Bosch, Jürgen
Boucher, Lauren E.
Boyom, Fabrice F.
Brea, Jose
Brennan, Marian
Burton, Audrey
Caffrey, Conor R.
Camarda, Grazia
Carrasquilla, Manuela
Carter, Dee
Belen Cassera, Maria
Chih-Chien Cheng, Ken
Chindaudomsate, Worathad
Chubb, Anthony
Colon, Beatrice L.
Colón-López, Daisy D.
Corbett, Yolanda
Crowther, Gregory J.
Cowan, Noemi
D’Alessandro, Sarah
Le Dang, Na
Delves, Michael
DeRisi, Joseph L.
Du, Alan Y.
Duffy, Sandra
Abd El-Salam El-Sayed, Shimaa
Ferdig, Michael T.
Fernández Robledo, José A.
Fidock, David A.
Florent, Isabelle
Fokou, Patrick V. T.
Galstian, Ani
Gamo, Francisco Javier
Gokool, Suzanne
Gold, Ben
Golub, Todd
Goldgof, Gregory M.
Guha, Rajarshi
Guiguemde, W. Armand
Gural, Nil
Guy, R. Kiplin
Hansen, Michael A. E.
Hanson, Kirsten K.
Hemphill, Andrew
Hooft van Huijsduijnen, Rob
Horii, Takaaki
Horrocks, Paul
Hughes, Tyler B.
Huston, Christopher
Igarashi, Ikuo
Ingram-Sieber, Katrin
Itoe, Maurice A.
Jadhav, Ajit
Naranuntarat Jensen, Amornrat
Jensen, Laran T.
Jiang, Rays H.Y.
Kaiser, Annette
Keiser, Jennifer
Ketas, Thomas
Kicka, Sebastien
Kim, Sunyoung
Kirk, Kiaran
Kumar, Vidya P.
Kyle, Dennis E.
Lafuente, Maria Jose
Landfear, Scott
Lee, Nathan
Lee, Sukjun
Lehane, Adele M.
Li, Fengwu
Little, David
Liu, Liqiong
Llinás, Manuel
Loza, Maria I.
Lubar, Aristea
Lucantoni, Leonardo
Lucet, Isabelle
Maes, Louis
Mancama, Dalu
Mansour, Nuha R.
March, Sandra
McGowan, Sheena
Medina Vera, Iset
Meister, Stephan
Mercer, Luke
Mestres, Jordi
Mfopa, Alvine N.
Misra, Raj N.
Moon, Seunghyun
Moore, John P.
Morais Rodrigues da Costa, Francielly
Müller, Joachim
Muriana, Arantza
Nakazawa Hewitt, Stephen
Nare, Bakela
Nathan, Carl
Narraidoo, Nathalie
Nawaratna, Sujeevi
Ojo, Kayode K.
Ortiz, Diana
Panic, Gordana
Papadatos, George
Parapini, Silvia
Patra, Kailash
Pham, Ngoc
Prats, Sarah
Plouffe, David M.
Poulsen, Sally-Ann
Pradhan, Anupam
Quevedo, Celia
Quinn, Ronald J.
Rice, Christopher A.
Abdo Rizk, Mohamed
Ruecker, Andrea
St. Onge, Robert
Salgado Ferreira, Rafaela
Samra, Jasmeet
Robinett, Natalie G.
Schlecht, Ulrich
Schmitt, Marjorie
Silva Villela, Filipe
Silvestrini, Francesco
Sinden, Robert
Smith, Dennis A.
Soldati, Thierry
Spitzmüller, Andreas
Stamm, Serge Maximilian
Sullivan, David J.
Sullivan, William
Suresh, Sundari
Suzuki, Brian M.
Suzuki, Yo
Swamidass, S. Joshua
Taramelli, Donatella
Tchokouaha, Lauve R.Y.
Theron, Anjo
Thomas, David
Tonissen, Kathryn F.
Townson, Simon
Tripathi, Abhai K.
Trofimov, Valentin
Udenze, Kenneth O.
Ullah, Imran
Vallieres, Cindy
Vigil, Edgar
Vinetz, Joseph M.
Voong Vinh, Phat
Vu, Hoan
Watanabe, Nao-aki
Weatherby, Kate
White, Pamela M.
Wilks, Andrew F.
Winzeler, Elizabeth A.
Wojcik, Edward
Wree, Melanie
Wu, Wesley
Yokoyama, Naoaki
Zollo, Paul H. A.
Abla, Nada
Blasco, Benjamin
Burrows, Jeremy
Laleu, Benoît
Leroy, Didier
Spangenberg, Thomas
Wells, Timothy
Willis, Paul A.
author_sort Phillips, Margaret A.
building Nottingham Research Data Repository
collection Online Access
description A major cause of the paucity of new starting points for drug discovery is the lack of interaction between academia and industry. Much of the global resource in biology is present in universities, whereas the focus of medicinal chemistry is still largely within industry. Open source drug discovery, with sharing of information, is clearly a first step towards overcoming this gap. But the interface could especially be bridged through a scale-up of open sharing of physical compounds, which would accelerate the finding of new starting points for drug discovery. The Medicines for Malaria Venture Malaria Box is a collection of over 400 compounds representing families of structures identified in phenotypic screens of pharmaceutical and academic libraries against the Plasmodium falciparum malaria parasite. The set has now been distributed to almost 200 research groups globally in the last two years, with the only stipulation that information from the screens is deposited in the public domain. This paper reports for the first time on 236 screens that have been carried out against the Malaria Box and compares these results with 55 assays that were previously published, in a format that allows a meta-analysis of the combined dataset. The combined biochemical and cellular assays presented here suggest mechanisms of action for 135 (34%) of the compounds active in killing multiple life-cycle stages of the malaria parasite, including asexual blood, liver, gametocyte, gametes and insect ookinete stages. In addition, many compounds demonstrated activity against other pathogens, showing hits in assays with 16 protozoa, 7 helminths, 9 bacterial and mycobacterial species, the dengue fever mosquito vector, and the NCI60 human cancer cell line panel of 60 human tumor cell lines. Toxicological, pharmacokinetic and metabolic properties were collected on all the compounds, assisting in the selection of the most promising candidates for murine proof-of-concept experiments and medicinal chemistry programs. The data for all of these assays are presented and analyzed to show how outstanding leads for many indications can be selected. These results reveal the immense potential for translating the dispersed expertise in biological assays involving human pathogens into drug discovery starting points, by providing open access to new families of molecules, and emphasize how a small additional investment made to help acquire and distribute compounds, and sharing the data, can catalyze drug discovery for dozens of different indications. Another lesson is that when multiple screens from different groups are run on the same library, results can be integrated quickly to select the most valuable starting points for subsequent medicinal chemistry efforts.
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spelling nottingham-377332020-05-04T17:59:19Z https://eprints.nottingham.ac.uk/37733/ Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond Phillips, Margaret A. Van Voorhis, Wesley C. Adams, John H. Adelfio, Roberto Ahyong, Vida Akabas, Myles H. Alano, Pietro Alday, Aintzane Alemán Resto, Yesmalie Alsibaee, Aishah Alzualde, Ainhoa Andrews, Katherine T. Avery, Simon V. Avery, Vicky M. Ayong, Lawrence Baker, Mark Baker, Stephen Ben Mamoun, Choukri Bhatia, Sangeeta Bickle, Quentin Bounaadja, Lotfi Bowling, Tana Bosch, Jürgen Boucher, Lauren E. Boyom, Fabrice F. Brea, Jose Brennan, Marian Burton, Audrey Caffrey, Conor R. Camarda, Grazia Carrasquilla, Manuela Carter, Dee Belen Cassera, Maria Chih-Chien Cheng, Ken Chindaudomsate, Worathad Chubb, Anthony Colon, Beatrice L. Colón-López, Daisy D. Corbett, Yolanda Crowther, Gregory J. Cowan, Noemi D’Alessandro, Sarah Le Dang, Na Delves, Michael DeRisi, Joseph L. Du, Alan Y. Duffy, Sandra Abd El-Salam El-Sayed, Shimaa Ferdig, Michael T. Fernández Robledo, José A. Fidock, David A. Florent, Isabelle Fokou, Patrick V. T. Galstian, Ani Gamo, Francisco Javier Gokool, Suzanne Gold, Ben Golub, Todd Goldgof, Gregory M. Guha, Rajarshi Guiguemde, W. Armand Gural, Nil Guy, R. Kiplin Hansen, Michael A. E. Hanson, Kirsten K. Hemphill, Andrew Hooft van Huijsduijnen, Rob Horii, Takaaki Horrocks, Paul Hughes, Tyler B. Huston, Christopher Igarashi, Ikuo Ingram-Sieber, Katrin Itoe, Maurice A. Jadhav, Ajit Naranuntarat Jensen, Amornrat Jensen, Laran T. Jiang, Rays H.Y. Kaiser, Annette Keiser, Jennifer Ketas, Thomas Kicka, Sebastien Kim, Sunyoung Kirk, Kiaran Kumar, Vidya P. Kyle, Dennis E. Lafuente, Maria Jose Landfear, Scott Lee, Nathan Lee, Sukjun Lehane, Adele M. Li, Fengwu Little, David Liu, Liqiong Llinás, Manuel Loza, Maria I. Lubar, Aristea Lucantoni, Leonardo Lucet, Isabelle Maes, Louis Mancama, Dalu Mansour, Nuha R. March, Sandra McGowan, Sheena Medina Vera, Iset Meister, Stephan Mercer, Luke Mestres, Jordi Mfopa, Alvine N. Misra, Raj N. Moon, Seunghyun Moore, John P. Morais Rodrigues da Costa, Francielly Müller, Joachim Muriana, Arantza Nakazawa Hewitt, Stephen Nare, Bakela Nathan, Carl Narraidoo, Nathalie Nawaratna, Sujeevi Ojo, Kayode K. Ortiz, Diana Panic, Gordana Papadatos, George Parapini, Silvia Patra, Kailash Pham, Ngoc Prats, Sarah Plouffe, David M. Poulsen, Sally-Ann Pradhan, Anupam Quevedo, Celia Quinn, Ronald J. Rice, Christopher A. Abdo Rizk, Mohamed Ruecker, Andrea St. Onge, Robert Salgado Ferreira, Rafaela Samra, Jasmeet Robinett, Natalie G. Schlecht, Ulrich Schmitt, Marjorie Silva Villela, Filipe Silvestrini, Francesco Sinden, Robert Smith, Dennis A. Soldati, Thierry Spitzmüller, Andreas Stamm, Serge Maximilian Sullivan, David J. Sullivan, William Suresh, Sundari Suzuki, Brian M. Suzuki, Yo Swamidass, S. Joshua Taramelli, Donatella Tchokouaha, Lauve R.Y. Theron, Anjo Thomas, David Tonissen, Kathryn F. Townson, Simon Tripathi, Abhai K. Trofimov, Valentin Udenze, Kenneth O. Ullah, Imran Vallieres, Cindy Vigil, Edgar Vinetz, Joseph M. Voong Vinh, Phat Vu, Hoan Watanabe, Nao-aki Weatherby, Kate White, Pamela M. Wilks, Andrew F. Winzeler, Elizabeth A. Wojcik, Edward Wree, Melanie Wu, Wesley Yokoyama, Naoaki Zollo, Paul H. A. Abla, Nada Blasco, Benjamin Burrows, Jeremy Laleu, Benoît Leroy, Didier Spangenberg, Thomas Wells, Timothy Willis, Paul A. A major cause of the paucity of new starting points for drug discovery is the lack of interaction between academia and industry. Much of the global resource in biology is present in universities, whereas the focus of medicinal chemistry is still largely within industry. Open source drug discovery, with sharing of information, is clearly a first step towards overcoming this gap. But the interface could especially be bridged through a scale-up of open sharing of physical compounds, which would accelerate the finding of new starting points for drug discovery. The Medicines for Malaria Venture Malaria Box is a collection of over 400 compounds representing families of structures identified in phenotypic screens of pharmaceutical and academic libraries against the Plasmodium falciparum malaria parasite. The set has now been distributed to almost 200 research groups globally in the last two years, with the only stipulation that information from the screens is deposited in the public domain. This paper reports for the first time on 236 screens that have been carried out against the Malaria Box and compares these results with 55 assays that were previously published, in a format that allows a meta-analysis of the combined dataset. The combined biochemical and cellular assays presented here suggest mechanisms of action for 135 (34%) of the compounds active in killing multiple life-cycle stages of the malaria parasite, including asexual blood, liver, gametocyte, gametes and insect ookinete stages. In addition, many compounds demonstrated activity against other pathogens, showing hits in assays with 16 protozoa, 7 helminths, 9 bacterial and mycobacterial species, the dengue fever mosquito vector, and the NCI60 human cancer cell line panel of 60 human tumor cell lines. Toxicological, pharmacokinetic and metabolic properties were collected on all the compounds, assisting in the selection of the most promising candidates for murine proof-of-concept experiments and medicinal chemistry programs. The data for all of these assays are presented and analyzed to show how outstanding leads for many indications can be selected. These results reveal the immense potential for translating the dispersed expertise in biological assays involving human pathogens into drug discovery starting points, by providing open access to new families of molecules, and emphasize how a small additional investment made to help acquire and distribute compounds, and sharing the data, can catalyze drug discovery for dozens of different indications. Another lesson is that when multiple screens from different groups are run on the same library, results can be integrated quickly to select the most valuable starting points for subsequent medicinal chemistry efforts. Public Library of Science 2016-07-28 Article PeerReviewed Phillips, Margaret A., Van Voorhis, Wesley C., Adams, John H., Adelfio, Roberto, Ahyong, Vida, Akabas, Myles H., Alano, Pietro, Alday, Aintzane, Alemán Resto, Yesmalie, Alsibaee, Aishah, Alzualde, Ainhoa, Andrews, Katherine T., Avery, Simon V., Avery, Vicky M., Ayong, Lawrence, Baker, Mark, Baker, Stephen, Ben Mamoun, Choukri, Bhatia, Sangeeta, Bickle, Quentin, Bounaadja, Lotfi, Bowling, Tana, Bosch, Jürgen, Boucher, Lauren E., Boyom, Fabrice F., Brea, Jose, Brennan, Marian, Burton, Audrey, Caffrey, Conor R., Camarda, Grazia, Carrasquilla, Manuela, Carter, Dee, Belen Cassera, Maria, Chih-Chien Cheng, Ken, Chindaudomsate, Worathad, Chubb, Anthony, Colon, Beatrice L., Colón-López, Daisy D., Corbett, Yolanda, Crowther, Gregory J., Cowan, Noemi, D’Alessandro, Sarah, Le Dang, Na, Delves, Michael, DeRisi, Joseph L., Du, Alan Y., Duffy, Sandra, Abd El-Salam El-Sayed, Shimaa, Ferdig, Michael T., Fernández Robledo, José A., Fidock, David A., Florent, Isabelle, Fokou, Patrick V. T., Galstian, Ani, Gamo, Francisco Javier, Gokool, Suzanne, Gold, Ben, Golub, Todd, Goldgof, Gregory M., Guha, Rajarshi, Guiguemde, W. Armand, Gural, Nil, Guy, R. Kiplin, Hansen, Michael A. E., Hanson, Kirsten K., Hemphill, Andrew, Hooft van Huijsduijnen, Rob, Horii, Takaaki, Horrocks, Paul, Hughes, Tyler B., Huston, Christopher, Igarashi, Ikuo, Ingram-Sieber, Katrin, Itoe, Maurice A., Jadhav, Ajit, Naranuntarat Jensen, Amornrat, Jensen, Laran T., Jiang, Rays H.Y., Kaiser, Annette, Keiser, Jennifer, Ketas, Thomas, Kicka, Sebastien, Kim, Sunyoung, Kirk, Kiaran, Kumar, Vidya P., Kyle, Dennis E., Lafuente, Maria Jose, Landfear, Scott, Lee, Nathan, Lee, Sukjun, Lehane, Adele M., Li, Fengwu, Little, David, Liu, Liqiong, Llinás, Manuel, Loza, Maria I., Lubar, Aristea, Lucantoni, Leonardo, Lucet, Isabelle, Maes, Louis, Mancama, Dalu, Mansour, Nuha R., March, Sandra, McGowan, Sheena, Medina Vera, Iset, Meister, Stephan, Mercer, Luke, Mestres, Jordi, Mfopa, Alvine N., Misra, Raj N., Moon, Seunghyun, Moore, John P., Morais Rodrigues da Costa, Francielly, Müller, Joachim, Muriana, Arantza, Nakazawa Hewitt, Stephen, Nare, Bakela, Nathan, Carl, Narraidoo, Nathalie, Nawaratna, Sujeevi, Ojo, Kayode K., Ortiz, Diana, Panic, Gordana, Papadatos, George, Parapini, Silvia, Patra, Kailash, Pham, Ngoc, Prats, Sarah, Plouffe, David M., Poulsen, Sally-Ann, Pradhan, Anupam, Quevedo, Celia, Quinn, Ronald J., Rice, Christopher A., Abdo Rizk, Mohamed, Ruecker, Andrea, St. Onge, Robert, Salgado Ferreira, Rafaela, Samra, Jasmeet, Robinett, Natalie G., Schlecht, Ulrich, Schmitt, Marjorie, Silva Villela, Filipe, Silvestrini, Francesco, Sinden, Robert, Smith, Dennis A., Soldati, Thierry, Spitzmüller, Andreas, Stamm, Serge Maximilian, Sullivan, David J., Sullivan, William, Suresh, Sundari, Suzuki, Brian M., Suzuki, Yo, Swamidass, S. Joshua, Taramelli, Donatella, Tchokouaha, Lauve R.Y., Theron, Anjo, Thomas, David, Tonissen, Kathryn F., Townson, Simon, Tripathi, Abhai K., Trofimov, Valentin, Udenze, Kenneth O., Ullah, Imran, Vallieres, Cindy, Vigil, Edgar, Vinetz, Joseph M., Voong Vinh, Phat, Vu, Hoan, Watanabe, Nao-aki, Weatherby, Kate, White, Pamela M., Wilks, Andrew F., Winzeler, Elizabeth A., Wojcik, Edward, Wree, Melanie, Wu, Wesley, Yokoyama, Naoaki, Zollo, Paul H. A., Abla, Nada, Blasco, Benjamin, Burrows, Jeremy, Laleu, Benoît, Leroy, Didier, Spangenberg, Thomas, Wells, Timothy and Willis, Paul A. (2016) Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond. PLOS Pathogens, 12 (7). e1005763/1-e1005763/23. ISSN 1553-7374 http://journals.plos.org/plospathogens/article?id=10.1371/journal.ppat.1005763 doi:10.1371/journal.ppat.1005763 doi:10.1371/journal.ppat.1005763
spellingShingle Phillips, Margaret A.
Van Voorhis, Wesley C.
Adams, John H.
Adelfio, Roberto
Ahyong, Vida
Akabas, Myles H.
Alano, Pietro
Alday, Aintzane
Alemán Resto, Yesmalie
Alsibaee, Aishah
Alzualde, Ainhoa
Andrews, Katherine T.
Avery, Simon V.
Avery, Vicky M.
Ayong, Lawrence
Baker, Mark
Baker, Stephen
Ben Mamoun, Choukri
Bhatia, Sangeeta
Bickle, Quentin
Bounaadja, Lotfi
Bowling, Tana
Bosch, Jürgen
Boucher, Lauren E.
Boyom, Fabrice F.
Brea, Jose
Brennan, Marian
Burton, Audrey
Caffrey, Conor R.
Camarda, Grazia
Carrasquilla, Manuela
Carter, Dee
Belen Cassera, Maria
Chih-Chien Cheng, Ken
Chindaudomsate, Worathad
Chubb, Anthony
Colon, Beatrice L.
Colón-López, Daisy D.
Corbett, Yolanda
Crowther, Gregory J.
Cowan, Noemi
D’Alessandro, Sarah
Le Dang, Na
Delves, Michael
DeRisi, Joseph L.
Du, Alan Y.
Duffy, Sandra
Abd El-Salam El-Sayed, Shimaa
Ferdig, Michael T.
Fernández Robledo, José A.
Fidock, David A.
Florent, Isabelle
Fokou, Patrick V. T.
Galstian, Ani
Gamo, Francisco Javier
Gokool, Suzanne
Gold, Ben
Golub, Todd
Goldgof, Gregory M.
Guha, Rajarshi
Guiguemde, W. Armand
Gural, Nil
Guy, R. Kiplin
Hansen, Michael A. E.
Hanson, Kirsten K.
Hemphill, Andrew
Hooft van Huijsduijnen, Rob
Horii, Takaaki
Horrocks, Paul
Hughes, Tyler B.
Huston, Christopher
Igarashi, Ikuo
Ingram-Sieber, Katrin
Itoe, Maurice A.
Jadhav, Ajit
Naranuntarat Jensen, Amornrat
Jensen, Laran T.
Jiang, Rays H.Y.
Kaiser, Annette
Keiser, Jennifer
Ketas, Thomas
Kicka, Sebastien
Kim, Sunyoung
Kirk, Kiaran
Kumar, Vidya P.
Kyle, Dennis E.
Lafuente, Maria Jose
Landfear, Scott
Lee, Nathan
Lee, Sukjun
Lehane, Adele M.
Li, Fengwu
Little, David
Liu, Liqiong
Llinás, Manuel
Loza, Maria I.
Lubar, Aristea
Lucantoni, Leonardo
Lucet, Isabelle
Maes, Louis
Mancama, Dalu
Mansour, Nuha R.
March, Sandra
McGowan, Sheena
Medina Vera, Iset
Meister, Stephan
Mercer, Luke
Mestres, Jordi
Mfopa, Alvine N.
Misra, Raj N.
Moon, Seunghyun
Moore, John P.
Morais Rodrigues da Costa, Francielly
Müller, Joachim
Muriana, Arantza
Nakazawa Hewitt, Stephen
Nare, Bakela
Nathan, Carl
Narraidoo, Nathalie
Nawaratna, Sujeevi
Ojo, Kayode K.
Ortiz, Diana
Panic, Gordana
Papadatos, George
Parapini, Silvia
Patra, Kailash
Pham, Ngoc
Prats, Sarah
Plouffe, David M.
Poulsen, Sally-Ann
Pradhan, Anupam
Quevedo, Celia
Quinn, Ronald J.
Rice, Christopher A.
Abdo Rizk, Mohamed
Ruecker, Andrea
St. Onge, Robert
Salgado Ferreira, Rafaela
Samra, Jasmeet
Robinett, Natalie G.
Schlecht, Ulrich
Schmitt, Marjorie
Silva Villela, Filipe
Silvestrini, Francesco
Sinden, Robert
Smith, Dennis A.
Soldati, Thierry
Spitzmüller, Andreas
Stamm, Serge Maximilian
Sullivan, David J.
Sullivan, William
Suresh, Sundari
Suzuki, Brian M.
Suzuki, Yo
Swamidass, S. Joshua
Taramelli, Donatella
Tchokouaha, Lauve R.Y.
Theron, Anjo
Thomas, David
Tonissen, Kathryn F.
Townson, Simon
Tripathi, Abhai K.
Trofimov, Valentin
Udenze, Kenneth O.
Ullah, Imran
Vallieres, Cindy
Vigil, Edgar
Vinetz, Joseph M.
Voong Vinh, Phat
Vu, Hoan
Watanabe, Nao-aki
Weatherby, Kate
White, Pamela M.
Wilks, Andrew F.
Winzeler, Elizabeth A.
Wojcik, Edward
Wree, Melanie
Wu, Wesley
Yokoyama, Naoaki
Zollo, Paul H. A.
Abla, Nada
Blasco, Benjamin
Burrows, Jeremy
Laleu, Benoît
Leroy, Didier
Spangenberg, Thomas
Wells, Timothy
Willis, Paul A.
Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond
title Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond
title_full Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond
title_fullStr Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond
title_full_unstemmed Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond
title_short Open source drug discovery with the Malaria Box Compound collection for neglected diseases and beyond
title_sort open source drug discovery with the malaria box compound collection for neglected diseases and beyond
url https://eprints.nottingham.ac.uk/37733/
https://eprints.nottingham.ac.uk/37733/
https://eprints.nottingham.ac.uk/37733/