Small-Molecule CD4-Mimics [electronic resource] : Structure-Based Optimization of HIV-1 Entry Inhibition

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Tác giả:

Ngôn ngữ: eng

Ký hiệu phân loại: 620.1 Engineering mechanics and materials

Thông tin xuất bản: Washington, D.C. : Oak Ridge, Tenn. : United States. Dept. of Energy. Office of Science ; Distributed by the Office of Scientific and Technical Information, U.S. Dept. of Energy, 2016

Mô tả vật lý: Size: p. 330-334 : , digital, PDF file.

Bộ sưu tập: Metadata

ID: 261007

We report the optimization, based on computational, thermodynamic, and crystallographic data, of a series of small-molecule ligands of the Phe43 cavity of the envelope glycoprotein gp120 of human immunodeficiency virus (HIV) has been achieved. Importantly, biological evaluation revealed that the small-molecule CD4 mimics (4?7) inhibit HIV-1 entry into target cells with both significantly higher potency and neutralization breadth than previous congeners, while maintaining high selectivity for the target virus. Their binding mode was characterized via thermodynamic and crystallographic studies.
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