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    Rationalized Computer-Aided Design of Matrix-Metalloprotease-Selective Prodrugs

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    jain_et_al_2017_jmc.pdf (1.141Mb)
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    Publication date
    2017-05-25
    Author
    Jain, M.
    Harburn, J.J.
    Gill, Jason H.
    Loadman, Paul cc
    Falconer, Robert A.
    Mooney, C.A.
    Cobb, S.L.
    Berry, David J.
    Keyword
    Computer-Aided Design; Prodrugs
    Rights
    (c) 2017 ACS. This document is the Accepted Manuscript version of a Published Work that appeared in final form in the Journal of Medicinal Chemistry. To access the final edited and published work see http://dx.doi.org/10.1021/acs.jmedchem.6b01472.
    Peer-Reviewed
    Yes
    
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    Abstract
    Matrix metalloproteinases (MMPs) are central to cancer development and metastasis. They are highly active in the tumor environment and absent or inactive in normal tissues; therefore they represent viable targets for cancer drug discovery. In this study we evaluated in silico docking to develop MMP-subtype-selective tumor-activated prodrugs. Proof of principle for this therapeutic approach was demonstrated in vitro against an aggressive human glioma model, with involvement of MMPs confirmed using pharmacological inhibition.
    URI
    http://hdl.handle.net/10454/12041
    Version
    Accepted Manuscript
    Citation
    Jain M, Harburn JJ, Gill JH et al (2017) Rationalized Computer-Aided Design of Matrix- Metalloprotease-Selective Prodrugs. Journal of Medicinal Chemistry. 60(10): 4496-4502.
    Link to publisher’s version
    http://dx.doi.org/10.1021/acs.jmedchem.6b01472
    Type
    Article
    Collections
    Life Sciences Publications

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