03978nam 2201093z- 450 991055749770332120220111(CKB)5400000000042854(oapen)https://directory.doabooks.org/handle/20.500.12854/76609(oapen)doab76609(EXLCZ)99540000000004285420202201d2021 |y 0engurmn|---annantxtrdacontentcrdamediacrrdacarrierProtein-Ligand Interactions: Target Identification and Drug DiscoveryBasel, SwitzerlandMDPI - Multidisciplinary Digital Publishing Institute20211 online resource (184 p.)3-0365-1050-8 3-0365-1051-6 Bioactive compounds and drugs are designed and screened on the basis of specific molecular targets as well as via the identification of active ingredients from traditional medicine or by serendipitous discovery. The development of novel therapeutic strategies not only requires a deep knowledge of the molecular processes and the cellular pathways involved in each pathological condition and disease, but also the specific protein targets and the effects of drug binding on protein conformation and activity. Understanding of how drugs can modify and modulate specific cellular pathways and functions will be helpful during the process of drug development and clinical trials.Protein—Ligand InteractionsProtein-Ligand InteractionsProtein–Ligand InteractionsChemistrybicsscResearch and information: generalbicsscACEacetylcholinesteraseamyloid beta aggregationbrassicasterolcancercell deathcell viabilityCoCl2drug developmentdrug discoveryendocrine disruptor compoundfatty acid conjugationFcRn-mediated recyclingfluorescence spectroscopyGADD45βheat shock protein 70Hsp70HSVHSV-1 DNA polymeraseHSV-1 TKhuman CDK2human umbilical arterykinase regulationlipid signallinglipid-protein interactionlung cancer cell linemembranemitochondrial membrane potentialMKK7molecular biophysicsmolecular dockingmolecular docking simulationmolecular dynamicsmulti-target drugmultiple myelomaMycobacterium tuberculosisNCI60 COMPARE analysisneuroprotectionPGRMC1phosphatidylinositolsphytosterolspiperineprotein-ligand interactionreactive oxygen species (ROS)serum albuminserum half-life extensionsigma ligandssigma receptorsSIGMAR1small-molecule derivatives of salicylanilideSTD-NMRstructure-activity relationshiptarget identificationthyroid diseasesTMEM97translocator protein (TSPO)UDP-galactopyranose mutasevascular homeostasisChemistryResearch and information: generalAltieri Fabioedt1311497Altieri FabioothBOOK9910557497703321Protein-Ligand Interactions: Target Identification and Drug Discovery3030346UNINA