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Results: 1 to 20 of 33

1.

A computational approach to finding novel targets for existing drugs.

Li YY, An J, Jones SJ.

PLoS Comput Biol. 2011 Sep;7(9):e1002139. doi: 10.1371/journal.pcbi.1002139. Epub 2011 Sep 1.

PMID:
21909252
[PubMed - indexed for MEDLINE]
Free PMC Article
2.

Chemical-protein interactome and its application in off-target identification.

Yang L, Wang KJ, Wang LS, Jegga AG, Qin SY, He G, Chen J, Xiao Y, He L.

Interdiscip Sci. 2011 Mar;3(1):22-30. doi: 10.1007/s12539-011-0051-8. Epub 2011 Mar 3. Review.

PMID:
21369884
[PubMed - indexed for MEDLINE]
3.

The chemical basis of pharmacology.

Keiser MJ, Irwin JJ, Shoichet BK.

Biochemistry. 2010 Dec 7;49(48):10267-76. doi: 10.1021/bi101540g. Epub 2010 Nov 12. Review.

PMID:
21058655
[PubMed - indexed for MEDLINE]
Free PMC Article
4.

Computational drug design targeting protein-protein interactions.

Bienstock RJ.

Curr Pharm Des. 2012;18(9):1240-54. Review.

PMID:
22316151
[PubMed - indexed for MEDLINE]
5.

Predicting targeted polypharmacology for drug repositioning and multi- target drug discovery.

Liu X, Zhu F, Ma XH, Shi Z, Yang SY, Wei YQ, Chen YZ.

Curr Med Chem. 2013;20(13):1646-61. Review.

PMID:
23410165
[PubMed - indexed for MEDLINE]
6.

[Development of antituberculous drugs: current status and future prospects].

Tomioka H, Namba K.

Kekkaku. 2006 Dec;81(12):753-74. Review. Japanese.

PMID:
17240921
[PubMed - indexed for MEDLINE]
7.

Importance of molecular computer modeling in anticancer drug development.

Geromichalos GD.

J BUON. 2007 Sep;12 Suppl 1:S101-18. Review.

PMID:
17935268
[PubMed - indexed for MEDLINE]
8.

Old friends in new guise: repositioning of known drugs with structural bioinformatics.

Haupt VJ, Schroeder M.

Brief Bioinform. 2011 Jul;12(4):312-26. doi: 10.1093/bib/bbr011. Epub 2011 Mar 26. Review.

PMID:
21441562
[PubMed - indexed for MEDLINE]
Free Article
9.

Application of chemistry-based functional proteomics to screening for novel drug targets.

Yuan K, Lei Y, Huang C.

Comb Chem High Throughput Screen. 2010 Jun;13(5):414-21. Review.

PMID:
20156143
[PubMed - indexed for MEDLINE]
10.

Systems biology analysis of protein-drug interactions.

Colinge J, Rix U, Bennett KL, Superti-Furga G.

Proteomics Clin Appl. 2012 Jan;6(1-2):102-16. doi: 10.1002/prca.201100077. Epub 2011 Dec 27. Review.

PMID:
22213655
[PubMed - indexed for MEDLINE]
11.

Human disease and drug pharmacology, complex as real life.

Viayna E, Sola I, Di Pietro O, Muñoz-Torrero D.

Curr Med Chem. 2013;20(13):1623-34. Review.

PMID:
23410162
[PubMed - indexed for MEDLINE]
12.

Protein-protein interactions: network analysis and applications in drug discovery.

Bultinck J, Lievens S, Tavernier J.

Curr Pharm Des. 2012;18(30):4619-29. Review.

PMID:
22650261
[PubMed - indexed for MEDLINE]
13.

Computational methodologies for compound database searching that utilize experimental protein-ligand interaction information.

Tan L, Batista J, Bajorath J.

Chem Biol Drug Des. 2010 Sep 1;76(3):191-200. doi: 10.1111/j.1747-0285.2010.01007.x. Epub 2010 Jul 15. Review.

PMID:
20636330
[PubMed - indexed for MEDLINE]
14.

Computational resources for protein modelling and drug discovery applications.

Dhaliwal B, Chen YW.

Infect Disord Drug Targets. 2009 Nov;9(5):557-62. Review.

PMID:
19594423
[PubMed - indexed for MEDLINE]
15.

Drug discovery in the age of systems biology: the rise of computational approaches for data integration.

Iskar M, Zeller G, Zhao XM, van Noort V, Bork P.

Curr Opin Biotechnol. 2012 Aug;23(4):609-16. doi: 10.1016/j.copbio.2011.11.010. Epub 2011 Dec 5. Review.

PMID:
22153034
[PubMed - indexed for MEDLINE]
16.

From drug target to leads--sketching a physicochemical pathway for lead molecule design in silico.

Shaikh SA, Jain T, Sandhu G, Latha N, Jayaram B.

Curr Pharm Des. 2007;13(34):3454-70. Review.

PMID:
18220783
[PubMed - indexed for MEDLINE]
17.

Exploiting drug-disease relationships for computational drug repositioning.

Dudley JT, Deshpande T, Butte AJ.

Brief Bioinform. 2011 Jul;12(4):303-11. doi: 10.1093/bib/bbr013. Epub 2011 Jun 20. Review.

PMID:
21690101
[PubMed - indexed for MEDLINE]
Free PMC Article
18.

Drug repositioning by structure-based virtual screening.

Ma DL, Chan DS, Leung CH.

Chem Soc Rev. 2013 Mar 7;42(5):2130-41. doi: 10.1039/c2cs35357a. Epub 2013 Jan 4. Review.

PMID:
23288298
[PubMed - indexed for MEDLINE]
19.

Network-based drug repositioning.

Wu Z, Wang Y, Chen L.

Mol Biosyst. 2013 Jun;9(6):1268-81. doi: 10.1039/c3mb25382a. Epub 2013 Mar 14. Review.

PMID:
23493874
[PubMed - indexed for MEDLINE]
20.

Identification of direct protein targets of small molecules.

Lomenick B, Olsen RW, Huang J.

ACS Chem Biol. 2011 Jan 21;6(1):34-46. doi: 10.1021/cb100294v. Epub 2010 Nov 30. Review.

PMID:
21077692
[PubMed - indexed for MEDLINE]
Free PMC Article

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