A dynamic target-based pharmacophoric model mapping the CD4 binding site on HIV-1 gp120 to identify new inhibitors of gp120-CD4 protein-protein interactions. Export

@article{citeulike:5792821, abstract = {A dynamic target-based pharmacophoric model mapping the CD4 binding site on HIV-1 gp120 was built and used to identify new hits able to inhibit gp120-CD4 protein-protein interactions. Two compounds showed micromolar inhibition of HIV-1 replication in cells attributable to an interference with the entry step of infection, by direct interaction with gp120. Inactivity of compounds toward a M475I strain suggested specific contacts with the Phe43 cavity of gp120.}, author = {Caporuscio, Fabiana and Tafi, Andrea and Gonz\'{a}lez, Emmanuel and Manetti, Fabrizio and Est\'{e}, Jos\'{e} A. and Botta, Maurizio}, citeulike-article-id = {5792821}, citeulike-linkout-0 = {http://dx.doi.org/10.1016/j.bmcl.2009.09.029}, citeulike-linkout-1 = {http://linkinghub.elsevier.com/retrieve/pii/S0960894X09012864}, citeulike-linkout-2 = {http://view.ncbi.nlm.nih.gov/pubmed/19783140}, citeulike-linkout-3 = {http://www.hubmed.org/display.cgi?uids=19783140}, day = {13}, doi = {10.1016/j.bmcl.2009.09.029}, issn = {1464-3405}, journal = {Bioorganic \& medicinal chemistry letters}, keywords = {2009, cd4, hiv1, ppi, sm, xf}, month = {September}, posted-at = {2009-10-02 12:38:08}, priority = {3}, title = {A dynamic target-based pharmacophoric model mapping the CD4 binding site on HIV-1 gp120 to identify new inhibitors of gp120-CD4 protein-protein interactions.}, url = {http://dx.doi.org/10.1016/j.bmcl.2009.09.029}, year = {2009} }

TY - JOUR ID - citeulike:5792821 L3 - citeulike-article-id:5792821 N2 - A dynamic target-based pharmacophoric model mapping the CD4 binding site on HIV-1 gp120 was built and used to identify new hits able to inhibit gp120-CD4 protein-protein interactions. Two compounds showed micromolar inhibition of HIV-1 replication in cells attributable to an interference with the entry step of infection, by direct interaction with gp120. Inactivity of compounds toward a M475I strain suggested specific contacts with the Phe43 cavity of gp120. JF - Bioorganic & medicinal chemistry letters SN - 1464-3405 TI - A dynamic target-based pharmacophoric model mapping the CD4 binding site on HIV-1 gp120 to identify new inhibitors of gp120-CD4 protein-protein interactions. KW - 2009 KW - cd4 KW - hiv1 KW - ppi KW - sm KW - xf AU - Caporuscio, Fabiana AU - Tafi, Andrea AU - González, Emmanuel AU - Manetti, Fabrizio AU - Esté, José AU - Botta, Maurizio PY - 2009/09/13/ UR - http://dx.doi.org/10.1016/j.bmcl.2009.09.029 ER -