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Potent and selective isophthalamide S2 hydroxyethylamine inhibitors of BACE1

Bioorganic & medicinal chemistry letters, 2007-06, Vol.17 (12), p.3378-3383

2007

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Design, Synthesis, and Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitors of Human β-Secretase

Journal of medicinal chemistry, 2007-02, Vol.50 (4), p.776-781

2007

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Design and Synthesis of Hydroxyethylene-Based Peptidomimetic Inhibitors of Human β-Secretase

Journal of medicinal chemistry, 2004-01, Vol.47 (1), p.158-164

2004

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Design of potent inhibitors of human β-secretase. Part 1

Bioorganic & medicinal chemistry letters, 2007, Vol.17 (1), p.73-77

2007

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Identification, synthesis and SAR of amino substituted pyrido[3,2b]pyrazinones as potent and selective PDE5 inhibitors

Bioorganic & medicinal chemistry letters, 2009-08, Vol.19 (15), p.4088-4091

2009

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Design of potent inhibitors of human β-secretase. Part 2

Bioorganic & medicinal chemistry letters, 2007, Vol.17 (1), p.78-81

2007

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Investigation of aminopyridiopyrazinones as PDE5 inhibitors: Evaluation of modifications to the central ring system

Bioorganic & medicinal chemistry letters, 2009-08, Vol.19 (15), p.4092-4096

2009

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Optimization of the aminopyridopyrazinones class of PDE5 inhibitors: Discovery of 3-[( trans-4-hydroxycyclohexyl)amino]-7-(6-methoxypyridin-3-yl)-1-(2-propoxyethyl)pyrido[3,4- b]pyrazin-2(1 H)-one

Bioorganic & medicinal chemistry letters, 2009-09, Vol.19 (17), p.5209-5213

2009

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Computer design of bioactive molecules: A method for receptor-based de novo ligand design

Proteins, structure, function, and bioinformatics, 1991-12, Vol.11 (4), p.314-328

1991

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Cation binding to the integrin CD11b I domain and activation model assessment

Structure (London), 1998-07, Vol.6 (7), p.923-935

1998

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Orion ® A Cloud‐Native Molecular Design Platform

Computational Drug Discovery, 2024, p.579-615

2024

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Primary and secondary kinetic deuterium isotope effects and transition-state structures for benzylic chlorination and bromination of toluene

Journal of the American Chemical Society, 1987-08, Vol.109 (16), p.4926-4930

1987

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Inhibitors of the protease from human immunodeficiency virus: design and modeling of a compound containing a dihydroxyethylene isostere insert with high binding affinity and effective antiviral activity

Journal of medicinal chemistry, 1991-08, Vol.34 (8), p.2344-2356

1991

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Potent and selective isophthalamide S 2 hydroxyethylamine inhibitors of BACE1

Bioorganic & medicinal chemistry letters, 2007-06, Vol.17 (12), p.3378-3383

2007

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Potent and selective isophthalamide S sub(2) hydroxyethylamine inhibitors of BACE1

Bioorganic & medicinal chemistry letters, 2007-06, Vol.17 (12), p.3378-3383

2007

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Structure-Based Design of HIV Protease Inhibitors: 4-Hydroxycoumarins and 4-Hydroxy-2-pyrones as Non-peptidic Inhibitors

Journal of medicinal chemistry, 1994-09, Vol.37 (20), p.3200-3204

1994

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Intramolecular kinetic deuterium isotope effects on microsomal hydroxylation and chemical chlorination of toluene-.alpha.-d1 and toluene-.alpha.,.alpha.-d2

Journal of the American Chemical Society, 1985-11, Vol.107 (24), p.7164-7167

1985

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Structure-Based Design of Novel HIV Protease Inhibitors: Carboxamide-Containing 4-Hydroxycoumarins and 4-Hydroxy-2-pyrones as Potent Nonpeptidic Inhibitors

Journal of medicinal chemistry, 1995-09, Vol.38 (18), p.3624-3637

1995

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Reversible covalent inhibition of papain by a peptide nitrile. Carbon-13 NMR evidence for a thioimidate ester adduct

Journal of the American Chemical Society, 1986-03, Vol.108 (6), p.1350-1351

1986

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When Danny said no! Refusal of treatment by a patient of questionable competence

The Journal of Medical Humanities and Bioethics, 1985-03, Vol.6 (1), p.12-27

1985

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Crystal structure of a complex of HIV‐1 protease with a dihydroxyethylene‐containing inhibitor: Comparisons with molecular modeling

Protein science, 1992-08, Vol.1 (8), p.1061-1072

1992

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Reversible covalent binding of peptide nitriles to papain

Biochimica et biophysica acta, 1990-07, Vol.1035 (1), p.62-70

1990

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3D database searching and de novo construction methods in molecular design

Tetrahedron computer methodology, 1990, Vol.3 (6), p.697-711

1990

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Potent and selective isophthalamide S2 hydroxyethylamine inhibitors of BACE1

Design, Synthesis, and Crystal Structure of Hydroxyethyl Secondary Amine-Based Peptidomimetic Inhibitors of Human β-Secretase

Design and Synthesis of Hydroxyethylene-Based Peptidomimetic Inhibitors of Human β-Secretase

Design of potent inhibitors of human β-secretase. Part 1

Design, Synthesis, and Biological Evaluation of 3-[4-(2-Hydroxyethyl)piperazin-1-yl]-7-(6-methoxypyridin-3-yl)-1-(2-propoxyethyl)pyrido[3,4-b]pyrazin-2(1H)-one, a Potent, Orally Active, Brain Penetrant Inhibitor of Phosphodiesterase 5 (PDE5)

Identification, synthesis and SAR of amino substituted pyrido[3,2b]pyrazinones as potent and selective PDE5 inhibitors

Design of potent inhibitors of human β-secretase. Part 2

Investigation of aminopyridiopyrazinones as PDE5 inhibitors: Evaluation of modifications to the central ring system

Optimization of the aminopyridopyrazinones class of PDE5 inhibitors: Discovery of 3-[( trans-4-hydroxycyclohexyl)amino]-7-(6-methoxypyridin-3-yl)-1-(2-propoxyethyl)pyrido[3,4- b]pyrazin-2(1 H)-one

Computer design of bioactive molecules: A method for receptor-based de novo ligand design

Cation binding to the integrin CD11b I domain and activation model assessment

Orion ® A Cloud‐Native Molecular Design Platform

Primary and secondary kinetic deuterium isotope effects and transition-state structures for benzylic chlorination and bromination of toluene

Inhibitors of the protease from human immunodeficiency virus: design and modeling of a compound containing a dihydroxyethylene isostere insert with high binding affinity and effective antiviral activity

Potent and selective isophthalamide S 2 hydroxyethylamine inhibitors of BACE1

Potent and selective isophthalamide S sub(2) hydroxyethylamine inhibitors of BACE1

Discovery of an Oral Potent Selective Inhibitor of Hematopoietic Prostaglandin D Synthase (HPGDS)

Structure-Based Design of HIV Protease Inhibitors: 4-Hydroxycoumarins and 4-Hydroxy-2-pyrones as Non-peptidic Inhibitors

Intramolecular kinetic deuterium isotope effects on microsomal hydroxylation and chemical chlorination of toluene-.alpha.-d1 and toluene-.alpha.,.alpha.-d2

Structure-Based Design of Novel HIV Protease Inhibitors: Carboxamide-Containing 4-Hydroxycoumarins and 4-Hydroxy-2-pyrones as Potent Nonpeptidic Inhibitors

Reversible covalent inhibition of papain by a peptide nitrile. Carbon-13 NMR evidence for a thioimidate ester adduct

When Danny said no! Refusal of treatment by a patient of questionable competence

Crystal structure of a complex of HIV‐1 protease with a dihydroxyethylene‐containing inhibitor: Comparisons with molecular modeling

Reversible covalent binding of peptide nitriles to papain

3D database searching and de novo construction methods in molecular design

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