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Volumn 55, Issue 22, 2012, Pages 9763-9772

Rules for identifying potentially reactive or promiscuous compounds

Author keywords

[No Author keywords available]

Indexed keywords

ALDEHYDE; AMINE; ARTEMISININ; CHLORPROMAZINE; HALOGEN; KETONE; NITROGEN; PHOSPHORUS; VINYL DERIVATIVE;

EID: 84870026354     PISSN: 00222623     EISSN: 15204804     Source Type: Journal    
DOI: 10.1021/jm301008n     Document Type: Article
Times cited : (263)

References (39)
  • 1
    • 33745188660 scopus 로고    scopus 로고
    • Screening in a spirit haunted world
    • Shoichet, B. K. Screening in a spirit haunted world Drug Discovery Today 2006, 11, 607-615
    • (2006) Drug Discovery Today , vol.11 , pp. 607-615
    • Shoichet, B.K.1
  • 2
    • 77952545106 scopus 로고    scopus 로고
    • Apparent activity in high-throughput screening: Origins of compound-dependent assay interference
    • Thorne, N.; Auld, D. S.; Inglese, J. Apparent activity in high-throughput screening: origins of compound-dependent assay interference Curr. Opin. Chem. Biol. 2010, 14, 315-324
    • (2010) Curr. Opin. Chem. Biol. , vol.14 , pp. 315-324
    • Thorne, N.1    Auld, D.S.2    Inglese, J.3
  • 3
    • 0037061628 scopus 로고    scopus 로고
    • A common mechanism underlying promiscuous inhibitors from virtual and high-throughput screening
    • McGovern, S. L.; Caselli, E.; Grigorieff, N.; Shoichet, B. K. A common mechanism underlying promiscuous inhibitors from virtual and high-throughput screening J. Med. Chem. 2002, 45, 1712-1722
    • (2002) J. Med. Chem. , vol.45 , pp. 1712-1722
    • McGovern, S.L.1    Caselli, E.2    Grigorieff, N.3    Shoichet, B.K.4
  • 4
    • 33745381593 scopus 로고    scopus 로고
    • An empirical process for the design of high-throughput screening deck filters
    • Pearce, B. C.; Sofia, M. J.; Good, A. C.; Drexler, D. M.; Stock, D. A. An empirical process for the design of high-throughput screening deck filters J. Chem. Inf. Model. 2006, 46, 1060-1068
    • (2006) J. Chem. Inf. Model. , vol.46 , pp. 1060-1068
    • Pearce, B.C.1    Sofia, M.J.2    Good, A.C.3    Drexler, D.M.4    Stock, D.A.5
  • 5
    • 77950571108 scopus 로고    scopus 로고
    • New substructure filters for removal of pan assay interference compounds (PAINS) from screening libraries and for their exclusion in bioassays
    • Baell, J. B.; Holloway, G. A. 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, 2719-2740
    • (2010) J. Med. Chem. , vol.53 , pp. 2719-2740
    • Baell, J.B.1    Holloway, G.A.2
  • 6
    • 0030756360 scopus 로고    scopus 로고
    • Reactive compounds and in vitro false positives in HTS
    • Rishton, G. M. Reactive compounds and in vitro false positives in HTS Drug Discovery Today 1997, 2, 382-384
    • (1997) Drug Discovery Today , vol.2 , pp. 382-384
    • Rishton, G.M.1
  • 8
    • 0037394124 scopus 로고    scopus 로고
    • Designing screens: How to make your hits a hit
    • Walters, W. P.; Namchuk, M. Designing screens: how to make your hits a hit Nat. Rev. Drug Discovery 2003, 2, 259-266
    • (2003) Nat. Rev. Drug Discovery , vol.2 , pp. 259-266
    • Walters, W.P.1    Namchuk, M.2
  • 9
    • 0037439447 scopus 로고    scopus 로고
    • Nonleadlikeness and leadlikeness in biochemical screening
    • Rishton, G. M. Nonleadlikeness and leadlikeness in biochemical screening Drug Discovery Today 2003, 8, 86-96
    • (2003) Drug Discovery Today , vol.8 , pp. 86-96
    • Rishton, G.M.1
  • 11
    • 84871078958 scopus 로고    scopus 로고
    • MSI Cerius2. http://www.chem.cmu.edu/courses/09-560/docs/msi/modenv/D- Files.html#948951
    • MSI Cerius2
  • 13
    • 4544338170 scopus 로고    scopus 로고
    • Assessment of the consistency of medicinal chemists in reviewing sets of compounds
    • Lajiness, M. S.; Maggiora, G. M.; Shanmugasundaram, V. Assessment of the consistency of medicinal chemists in reviewing sets of compounds J. Med. Chem. 2004, 47, 4891-4896
    • (2004) J. Med. Chem. , vol.47 , pp. 4891-4896
    • Lajiness, M.S.1    Maggiora, G.M.2    Shanmugasundaram, V.3
  • 15
    • 0036882396 scopus 로고    scopus 로고
    • Irreversible inhibitors of serine, cysteine, and threonine proteases
    • Powers, J. C.; Asgian, J. L.; Ekici, Ö. D.; James, K. E. Irreversible inhibitors of serine, cysteine, and threonine proteases Chem. Rev. 2002, 102, 4639-4750
    • (2002) Chem. Rev. , vol.102 , pp. 4639-4750
    • Powers, J.C.1    Asgian, J.L.2    Ekici, Ö.D.3    James, K.E.4
  • 16
    • 0343433408 scopus 로고    scopus 로고
    • Cysteine proteases and their inhibitors
    • Otto, H.-H.; Schirmeister, T. Cysteine proteases and their inhibitors Chem. Rev. 1997, 97, 133-172
    • (1997) Chem. Rev. , vol.97 , pp. 133-172
    • Otto, H.-H.1    Schirmeister, T.2
  • 17
    • 2542425429 scopus 로고    scopus 로고
    • Structure-activity relationships of pyrithiones: IPC-81 toxicity tests with the antifouling biocide zinc pyrithione and structural analogs
    • Doose, C. A.; Ranke, J.; Stock, F.; Bottin-Weber, U.; Jastorff, B. Structure-activity relationships of pyrithiones: IPC-81 toxicity tests with the antifouling biocide zinc pyrithione and structural analogs Green Chem. 2004, 6, 259-266
    • (2004) Green Chem. , vol.6 , pp. 259-266
    • Doose, C.A.1    Ranke, J.2    Stock, F.3    Bottin-Weber, U.4    Jastorff, B.5
  • 19
    • 0013793175 scopus 로고
    • Complex formation between ethidium bromide and nucleic acids
    • Waring, M. J. Complex formation between ethidium bromide and nucleic acids J. Mol. Biol. 1965, 13, 269-282
    • (1965) J. Mol. Biol. , vol.13 , pp. 269-282
    • Waring, M.J.1
  • 21
    • 71049126548 scopus 로고    scopus 로고
    • Escape from Flatland: Increasing saturation as an approach to improving clinical success
    • Lovering, F.; Bikker, J.; Humblet, C. Escape from Flatland: increasing saturation as an approach to improving clinical success J. Med. Chem. 2009, 52, 6752-6756
    • (2009) J. Med. Chem. , vol.52 , pp. 6752-6756
    • Lovering, F.1    Bikker, J.2    Humblet, C.3
  • 23
    • 0018612308 scopus 로고
    • Antimalaria studies on qinghaosu
    • Qinghaosu Antimalarial Coordinating Research Group.
    • Qinghaosu Antimalarial Coordinating Research Group. Antimalaria studies on qinghaosu Chin. Med. J. 1979, 92, 811-816
    • (1979) Chin. Med. J. , vol.92 , pp. 811-816
  • 24
    • 49949151887 scopus 로고    scopus 로고
    • Molecular diversity in the context of leadlikeness: Compound properties that enable effective biochemical screening
    • Rishton, G. M. Molecular diversity in the context of leadlikeness: compound properties that enable effective biochemical screening Curr. Opin. Chem. Biol. 2008, 12, 340-351
    • (2008) Curr. Opin. Chem. Biol. , vol.12 , pp. 340-351
    • Rishton, G.M.1
  • 25
    • 33749623901 scopus 로고    scopus 로고
    • Leadlikeness and structural diversity of synthetic screening libraries
    • Verheij, H. Leadlikeness and structural diversity of synthetic screening libraries Mol. Diversity 2006, 10, 377-388
    • (2006) Mol. Diversity , vol.10 , pp. 377-388
    • Verheij, H.1
  • 27
    • 84871061583 scopus 로고    scopus 로고
    • The Research Group of Jon Tryggvi Njardarson at the University of Arizona
    • The Research Group of Jon Tryggvi Njardarson at the University of Arizona. http://cbc.arizona.edu/njardarson/group/.
  • 28
    • 0035438391 scopus 로고    scopus 로고
    • Is there a difference between leads and drugs? A historical perspective
    • Oprea, T. I.; Davis, A. M.; Teague, S. J.; Leeson, P. D. Is there a difference between leads and drugs? A historical perspective J. Chem. Inf. Comput. Sci. 2001, 41, 1308-1315
    • (2001) J. Chem. Inf. Comput. Sci. , vol.41 , pp. 1308-1315
    • Oprea, T.I.1    Davis, A.M.2    Teague, S.J.3    Leeson, P.D.4
  • 30
    • 0026198534 scopus 로고
    • Automation of the resazurin reduction test using fluorometry of microtitration trays
    • Ali-Vehmas, T.; Louhi, M.; Sandholm, M. Automation of the resazurin reduction test using fluorometry of microtitration trays J. Vet. Med., Ser. B 1991, 38, 358-372
    • (1991) J. Vet. Med., Ser. B , vol.38 , pp. 358-372
    • Ali-Vehmas, T.1    Louhi, M.2    Sandholm, M.3
  • 32
    • 77958044565 scopus 로고    scopus 로고
    • Observations on screening-based research and some concerning trends in the literature
    • Baell, J. B. Observations on screening-based research and some concerning trends in the literature Future Med. Chem. 2010, 2, 1529-1546
    • (2010) Future Med. Chem. , vol.2 , pp. 1529-1546
    • Baell, J.B.1
  • 34
    • 0017395981 scopus 로고
    • A new alkaloid AM-2282 of Streptomyces origin: Taxonomy, fermentation, isolation and preliminary characterization
    • Omura, S. I., Y.; Hirano, A.; Nakagawa, A.; Awaya, J.; Tsuchiya, H.; Takahashi, Y.; Masuma, R. A new alkaloid AM-2282 of Streptomyces origin: taxonomy, fermentation, isolation and preliminary characterization J. Antibiot. 1977, 30, 275-282
    • (1977) J. Antibiot. , vol.30 , pp. 275-282
    • Omura, S.I..Y.1    Hirano, A.2    Nakagawa, A.3    Awaya, J.4    Tsuchiya, H.5    Takahashi, Y.6    Masuma, R.7
  • 35
    • 0037431421 scopus 로고    scopus 로고
    • Kinase inhibitors: Not just for kinases anymore
    • McGovern, S. L.; Shoichet, B. K. Kinase inhibitors: not just for kinases anymore J. Med. Chem. 2003, 46, 1478-1483
    • (2003) J. Med. Chem. , vol.46 , pp. 1478-1483
    • McGovern, S.L.1    Shoichet, B.K.2
  • 38
    • 39149130730 scopus 로고    scopus 로고
    • Surface plasmon resonance based assay for the detection and characterization of promiscuous inhibitors
    • Giannetti, A. M.; Koch, B. D.; Browner, M. F. Surface plasmon resonance based assay for the detection and characterization of promiscuous inhibitors J. Med. Chem. 2008, 51, 574-580
    • (2008) J. Med. Chem. , vol.51 , pp. 574-580
    • Giannetti, A.M.1    Koch, B.D.2    Browner, M.F.3
  • 39
    • 0041842684 scopus 로고    scopus 로고
    • Effect of detergent on "promiscuous" inhibitors
    • Ryan, A. J.; Gray, N. M.; Lowe, P. N.; Chung, C.-w. Effect of detergent on "promiscuous" inhibitors J. Med. Chem. 2003, 46, 3448-3451
    • (2003) J. Med. Chem. , vol.46 , pp. 3448-3451
    • Ryan, A.J.1    Gray, N.M.2    Lowe, P.N.3    Chung, C.-W.4


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