Zobrazeno 1 - 10
of 17
pro vyhledávání: '"C. John Blankley"'
Publikováno v:
Journal of Molecular Graphics and Modelling. 21:421-433
This paper compares several published methods for clustering chemical structures, using both graph- and fingerprint-based similarity measures. The clusterings from each method were compared to determine the degree of cluster overlap. Each method was
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e77ee1ed5fd4840366b6a2c16d1b0d9e
https://doi.org/10.1016/s1093-3263(02)00188-2
https://doi.org/10.1016/s1093-3263(02)00188-2
Publikováno v:
Journal of Computer-Aided Molecular Design. 15:697-708
Summary The brain-blood partition coefficient (log BB) is a determining factor for the efficacy of central nervous system acting drugs. Since large-scale experimental determination of log BB is unfeasible, alternative evaluation methods based on theo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::fae79237eb0d14adcf09c9e143f65869
https://doi.org/10.1023/a:1012240703377
https://doi.org/10.1023/a:1012240703377
Autor:
Peter J. Tummino, Donna Ferguson, B. A. Steinbaugh, Kimberly Suzanne Para, Harriet W. Hamilton, J. V. N. Vara Prasad, Elizabeth A. Lunney, C. John Blankley
Publikováno v:
Bioorganic & Medicinal Chemistry Letters. 6:1099-1104
In a study of 4-hydroxy-pyran-2-ones as possible inhibitors of HIV protease, a series of compounds were synthesized following the Topliss operational scheme for substitution on a phenyl group at the 6 position of the pyrone. In addition, a number of
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::327c6c86935ad4112c36c2285a97c4dc
https://doi.org/10.1016/0960-894x(96)00180-1
https://doi.org/10.1016/0960-894x(96)00180-1
Publikováno v:
Journal of Heterocyclic Chemistry. 28:97-108
New derivatives of the naturally occurring amino acid 4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid (spinacine) are reported. These include amide, ester, 5-alkyl and acyl, and regiospecific N im -alkyl and aralkyl derivatives. Synthe
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d88bbea9be45309663af9e4dc36cc1f5
https://doi.org/10.1002/jhet.5570280118
https://doi.org/10.1002/jhet.5570280118
Autor:
David J Wild, C. John Blankley
Publikováno v:
Journal of molecular graphicsmodelling. 17(2)
VisualiSAR is a program designed to display chemical structures, find similarities and differences between them, and highlight relationships that might exist. The program integrates cluster analysis for the grouping of structurally related compounds,
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::107c2f62a9cedea5154b23ae3e3e179f
https://pubmed.ncbi.nlm.nih.gov/10680113
https://pubmed.ncbi.nlm.nih.gov/10680113
Autor:
Bruce D. Roth, Brian R. Krause, R. F. Bousley, C. John Blankley, R. L. Stanfield, Janak K. Padia, A. D. Essenburg, W. Howard Roark, Gary Louis Bolton
Publikováno v:
Bioorganicmedicinal chemistry. 3(1)
To examine the effects of bioisosteric replacement on the biological activity of our previously disclosed disubstituted urea inhibitors of the enzyme acyl-CoA:cholesterol acyltransferase (ACAT), we prepared a series of N'-substituted and N',N'-disubs
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::32ee4edbfef020914625285c22f11710
https://pubmed.ncbi.nlm.nih.gov/8612044
https://pubmed.ncbi.nlm.nih.gov/8612044
Autor:
Reynold Homan, Laura L. Minton, A. D. Essenburg, Andrew D. White, Charles L. Bisgaier, C. John Blankley
Publikováno v:
Lipids. 29(12)
The presence of plasma cholesteryl ester transfer protein (CETP) activity may be atherogenic, and, therefore, strategies to inhibit its activity or production may result in a beneficial effect on lipoprotein profiles and the disease process. The curr
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cf96ba91dd0c4434bb21d806d5fd71b5
https://pubmed.ncbi.nlm.nih.gov/7854005
https://pubmed.ncbi.nlm.nih.gov/7854005
Autor:
Andrew D. White, C. John Blankley
Publikováno v:
Trends in QSAR and Molecular Modelling 92 ISBN: 9789072199133
Trends in QSAR and Molecular Modelling 92
Trends in QSAR and Molecular Modelling 92
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::298eba0f23af78a4755e57bff6a25072
https://doi.org/10.1007/978-94-011-1472-1_73
https://doi.org/10.1007/978-94-011-1472-1_73
Autor:
Harvey R. Kaplan, C. John Blankley
Publikováno v:
Drug Development Research. 4:351-372
Both useful and undesirable cardiovascular properties have been associated with naturally occurring and synthetically derived phospholipids. Certain phospholipids may function physiologically (or pathophysiologically) in such processes as blood press
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::496cbeee5881d8612d991fa9686859ec
https://doi.org/10.1002/ddr.430040310
https://doi.org/10.1002/ddr.430040310