메뉴 건너뛰기




Volumn 57, Issue 4, 2017, Pages 875-882

Chemical Space Mimicry for Drug Discovery

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL ENGINEERING; CHEMISTRY;

EID: 85018554309     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/acs.jcim.6b00754     Document Type: Article
Times cited : (83)

References (15)
  • 1
    • 84877823346 scopus 로고    scopus 로고
    • Stochastic Voyages into Uncharted Chemical Space Produce a Representative Library of All Possible Drug-Like Compounds
    • Virshup, A. M.; Contreras-García, J.; Wipf, P.; Yang, W.; Beratan, D. N. Stochastic Voyages into Uncharted Chemical Space Produce a Representative Library of All Possible Drug-Like Compounds J. Am. Chem. Soc. 2013, 135 (19) 7296-7303 10.1021/ja401184g
    • (2013) J. Am. Chem. Soc. , vol.135 , Issue.19 , pp. 7296-7303
    • Virshup, A.M.1    Contreras-García, J.2    Wipf, P.3    Yang, W.4    Beratan, D.N.5
  • 2
    • 84925441528 scopus 로고    scopus 로고
    • Strategy to Discover Diverse Optimal Molecules in the Small Molecule Universe
    • Rupakheti, C.; Virshup, A.; Yang, W.; Beratan, D. N. J. Strategy To Discover Diverse Optimal Molecules in the Small Molecule Universe J. Chem. Inf. Model. 2015, 55 (3) 529-537 10.1021/ci500749q
    • (2015) J. Chem. Inf. Model. , vol.55 , Issue.3 , pp. 529-537
    • Rupakheti, C.1    Virshup, A.2    Yang, W.3    Beratan, D.N.J.4
  • 9
    • 0038512037 scopus 로고    scopus 로고
    • Molecular Shape Diversity of Combinatorial Libraries: A Prerequisite for Broad Bioactivity
    • Sauer, W. H. B.; Schwarz, M. K. Molecular Shape Diversity of Combinatorial Libraries: a Prerequisite for Broad Bioactivity J. Chem. Inf. Comput. Sci. 2003, 43, 987-1003 10.1021/ci025599w
    • (2003) J. Chem. Inf. Comput. Sci. , vol.43 , pp. 987-1003
    • Sauer, W.H.B.1    Schwarz, M.K.2
  • 10
    • 79953005609 scopus 로고    scopus 로고
    • PaDEL-descriptor: An Open Source Software to Calculate Molecular Descriptors and Fingerprints
    • Yap, C. W. PaDEL-descriptor: An Open Source Software to Calculate Molecular Descriptors and Fingerprints J. Comput. Chem. 2011, 32, 1466-1474 10.1002/jcc.21707
    • (2011) J. Comput. Chem. , vol.32 , pp. 1466-1474
    • Yap, C.W.1
  • 11
    • 84938212067 scopus 로고    scopus 로고
    • Targeting the IRE1-XBP1 Branch of the Unfolded Protein Response in Human Diseases
    • Jiang, D.; Niwa, M.; Koong, A. C. Targeting the IRE1-XBP1 Branch of the Unfolded Protein Response in Human Diseases Semin. Cancer Biol. 2015, 33, 48-56 10.1016/j.semcancer.2015.04.010
    • (2015) Semin. Cancer Biol. , vol.33 , pp. 48-56
    • Jiang, D.1    Niwa, M.2    Koong, A.C.3
  • 13
    • 33846108633 scopus 로고    scopus 로고
    • BindingDB: A Web-accessible Database of Experimentally Determined Protein-ligand Binding Affinities
    • Liu, T.; Lin, Y.; Wen, X.; Jorissen, R. N.; Gilson, M. K. BindingDB: A Web-accessible Database of Experimentally Determined Protein-ligand Binding Affinities Nucleic Acids Res. 2007, 35, D198-D201 10.1093/nar/gkl999
    • (2007) Nucleic Acids Res. , vol.35 , pp. D198-D201
    • Liu, T.1    Lin, Y.2    Wen, X.3    Jorissen, R.N.4    Gilson, M.K.5
  • 15
    • 34248178375 scopus 로고    scopus 로고
    • Inhibition of Angiogenesis and Invasion by 3,3′-diindolylmethane is Mediated by the Nuclear Factor-kappaB Downstream Target Genes MMP-9 and uPA That Regulated Bioavailability of Vascular Endothelial Growth Factor in Prostate Cancer
    • Kong, D.; Li, Y.; Wang, Z.; Banerjee, S.; Sarkar, F. H. Inhibition of Angiogenesis and Invasion by 3,3′-diindolylmethane is Mediated by the Nuclear Factor-kappaB Downstream Target Genes MMP-9 and uPA That Regulated Bioavailability of Vascular Endothelial Growth Factor in Prostate Cancer Cancer Res. 2007, 67 (7) 3310-3319 10.1158/0008-5472.CAN-06-4277
    • (2007) Cancer Res. , vol.67 , Issue.7 , pp. 3310-3319
    • Kong, D.1    Li, Y.2    Wang, Z.3    Banerjee, S.4    Sarkar, F.H.5


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.