Drug Design

Novel indoleamine 2,3-dioxygenase-1 inhibitors from a multistep in silico screen

Organic Chemistry / Enzyme Inhibitors / Humans / Drug Design / Thiourea / Enzyme / Bioorganic and medicinal Chemistry / In Silico / Protein Binding / Enzyme / Bioorganic and medicinal Chemistry / In Silico / Protein Binding

A Novel Bis-Tetrahydrofuranylurethane-Containing Nonpeptidic Protease Inhibitor (PI), GRL-98065, Is Potent against Multiple-PI-Resistant Human Immunodeficiency Virus In Vitro

Microbiology / Medical Microbiology / HIV / Humans / HIV protease / Drug Design / Human immunodeficiency virus / Spectrum / Active site / Antimicrobial agents / Microbial Sensitivity Tests / Amino Acid Profile / Amino Acid Sequence / Antiviral Activity / Binding Site / Furans / Drug Design / Human immunodeficiency virus / Spectrum / Active site / Antimicrobial agents / Microbial Sensitivity Tests / Amino Acid Profile / Amino Acid Sequence / Antiviral Activity / Binding Site / Furans

CNS Drug Delivery Systems: Novel Approaches

Pharmaceutical Technology / Drug delivery / Drug development / Drug Delivery System / Cerebrospinal Fluid / Brain / Humans / Cerebrovascular Disease / United States / Blood brain barrier / Drug Design / Central Nervous System / Drug Delivery Systems / Heart Disease / Drug Targeting / Trigeminal / Brain Tumour / Pharmaceutical preparations / Brain / Humans / Cerebrovascular Disease / United States / Blood brain barrier / Drug Design / Central Nervous System / Drug Delivery Systems / Heart Disease / Drug Targeting / Trigeminal / Brain Tumour / Pharmaceutical preparations

Plasma membrane electron transport: a new target for cancer drug development

Drug development / Humans / Anoxia / Animals / Drug Design / Glycolysis / Electron Transport / Antineoplastic Agents / Plasma Membrane / Glycolysis / Electron Transport / Antineoplastic Agents / Plasma Membrane

Plasma Membrane Electron Transport: A New Target for Cancer Drug Development

Drug development / Humans / Anoxia / Animals / Drug Design / Glycolysis / Electron Transport / Antineoplastic Agents / Plasma Membrane / Glycolysis / Electron Transport / Antineoplastic Agents / Plasma Membrane

Discovery of novel inhibitors of Trypanosoma cruzi trans-sialidase from in silico screening

Organic Chemistry / Kinetics / Modeling / Crystallization / Enzyme Inhibitors / Pharmaceutical Chemistry / Macromolecular X-Ray Crystallography / Crystal structure / In Vitro / Virtual screening / Animals / Ligand Binding / Drug Design / Molecular docking / Glycoproteins / Chagas disease / Enzyme / Neuraminidase / Active site / Trypanosoma Cruzi / Ether / Molecular Model / Bioorganic and medicinal Chemistry / Sialic Acid / In Silico / Drug Targeting / Ligands / Trans-Sialidase / Pharmaceutical Chemistry / Macromolecular X-Ray Crystallography / Crystal structure / In Vitro / Virtual screening / Animals / Ligand Binding / Drug Design / Molecular docking / Glycoproteins / Chagas disease / Enzyme / Neuraminidase / Active site / Trypanosoma Cruzi / Ether / Molecular Model / Bioorganic and medicinal Chemistry / Sialic Acid / In Silico / Drug Targeting / Ligands / Trans-Sialidase

SKPDB: a structural database of shikimate pathway enzymes

Relational Database / Computational Biology / Structure Based Drug Design / Biological Sciences / Protein Structure and Function / Software / Enzymes / Virtual screening / Mathematical Sciences / Drug Design / BMC Bioinformatics / Enzyme / Protein Sequence Analysis / Protein Conformation / Metabolic pathway / Amino Acid Sequence / Shikimic acid / Structural model / Software / Enzymes / Virtual screening / Mathematical Sciences / Drug Design / BMC Bioinformatics / Enzyme / Protein Sequence Analysis / Protein Conformation / Metabolic pathway / Amino Acid Sequence / Shikimic acid / Structural model

Plasmodium falciparum signal peptide peptidase is a promising drug target against blood stage malaria

Fluorescence Microscopy / Gene Silencing / Humans / Germ Cells / Animals / Drug Design / Endoplasmic Reticulum / ER stress / Biochemical / Protease Inhibitors / Presenilins / Plasmodium falciparum / Antimalarials / Heat Shock Proteins / Protein Conformation / Amino Acid Sequence / Erythrocytes / Drug Targeting / GFP / Carbamates / Biochemistry and cell biology / Drug Design / Endoplasmic Reticulum / ER stress / Biochemical / Protease Inhibitors / Presenilins / Plasmodium falciparum / Antimalarials / Heat Shock Proteins / Protein Conformation / Amino Acid Sequence / Erythrocytes / Drug Targeting / GFP / Carbamates / Biochemistry and cell biology

CNS Drug Delivery Systems: Novel Approaches

Pharmaceutical Technology / Drug delivery / Drug development / Drug Delivery System / Cerebrospinal Fluid / Brain / Humans / Cerebrovascular Disease / United States / Blood brain barrier / Drug Design / Central Nervous System / Drug Delivery Systems / Heart Disease / Drug Targeting / Trigeminal / Brain Tumour / Pharmaceutical preparations / Brain / Humans / Cerebrovascular Disease / United States / Blood brain barrier / Drug Design / Central Nervous System / Drug Delivery Systems / Heart Disease / Drug Targeting / Trigeminal / Brain Tumour / Pharmaceutical preparations

Synthesis of 13-amino costunolide derivatives as anticancer agents

Organic Chemistry / Pharmaceutical Chemistry / Cell line / Humans / Mice / Animals / Drug Design / Sesquiterpenes / Bioorganic and medicinal Chemistry / Indexation / Antineoplastic Agents / Animals / Drug Design / Sesquiterpenes / Bioorganic and medicinal Chemistry / Indexation / Antineoplastic Agents

Malarial dihydrofolate reductase as a paradigm for drug development against a resistance-compromised target

Drug development / Multidisciplinary / Macromolecular X-Ray Crystallography / Mice / Animals / Drug Resistance / Drug Design / Plasmodium falciparum / Antimalarials / Protein Conformation / Molecular Structure / Drug Resistance / Drug Design / Plasmodium falciparum / Antimalarials / Protein Conformation / Molecular Structure

ChemInform Abstract: Novel Design Principle Validated: Glucopyranosylidene-spiro-oxathiazole as New Nanomolar Inhibitor of Glycogen Phosphorylase, Potential Antidiabetic Agent

Organic Chemistry / Kinetics / Pharmaceutical Chemistry / Glucose / Animals / Drug Design / Oral Hypoglycemic Agents / Bioorganic and medicinal Chemistry / Rabbits / Thiazoles / Glycogen / Drug Design / Oral Hypoglycemic Agents / Bioorganic and medicinal Chemistry / Rabbits / Thiazoles / Glycogen

Pseudo-peptides derived from isomannide: inhibitors of serine proteases

Drug development / Hepatitis C / Humans / Drug Design / Enzyme / Amino Acids / Hepatocytes / Serine Protease / Cell Survival / Benzamides / Antiviral Agents / West Nile / Amino Acids / Hepatocytes / Serine Protease / Cell Survival / Benzamides / Antiviral Agents / West Nile

Synthesis of 13-amino costunolide derivatives as anticancer agents

Organic Chemistry / Pharmaceutical Chemistry / Cell line / Humans / Mice / Animals / Drug Design / Sesquiterpenes / Bioorganic and medicinal Chemistry / Indexation / Antineoplastic Agents / Animals / Drug Design / Sesquiterpenes / Bioorganic and medicinal Chemistry / Indexation / Antineoplastic Agents

Chemical Fragment Spaces for de novo Design

Computational Biology / Drug Design / Chemical Information / THEORETICAL AND COMPUTATIONAL CHEMISTRY / Molecular Structure / De Novo Design

Phenylpyrrole derivatives as neural and inducible nitric oxide synthase (nNOS and iNOS) inhibitors

Organic Chemistry / Enzyme Inhibitors / Mitochondria / Mice / Animals / Drug Design / European / Pyrazoles / Structure activity Relationship / Molecular Structure / Drug Design / European / Pyrazoles / Structure activity Relationship / Molecular Structure

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