Does adding the drug-drug similarity to drug-target interaction prediction methods make a noticeable improvement in their efficiency?
PMID:35836119
Structural Thermokinetic Modelling.
PMID:35629936
RoFDT: Identification of Drug-Target Interactions from Protein Sequence and Drug Molecular Structure Using Rotation Forest.
PMID:35625469
MSPEDTI: Prediction of Drug-Target Interactions via Molecular Structure with Protein Evolutionary Information.
PMID:35625468
A Genome-Scale Metabolic Model of Methanoperedens nitroreducens: Assessing Bioenergetics and Thermodynamic Feasibility.
PMID:35448501
Machine learning modeling of family wide enzyme-substrate specificity screens.
PMID:35143485
Draft Genome Sequence of Oceanobacillus jordanicus Strain GSFE11, a Halotolerant Plant Growth-Promoting Bacterial Endophyte Isolated From the Jordan Valley.
PMID:35095268
The Discovery of New Drug-Target Interactions for Breast Cancer Treatment.
PMID:34946556
Draft Genome Sequence of Bacillus pacificus KVCMST-8A-12, Isolated from a Marine Sediment Sample from the Kanyakumari Coast, India.
PMID:34913714
NeuRank: learning to rank with neural networks for drug-target interaction prediction.
PMID:34836495
Model Balancing: A Search for In-Vivo Kinetic Constants and Consistent Metabolic States.
PMID:34822407
A unified drug-target interaction prediction framework based on knowledge graph and recommendation system.
PMID:34811351
Whole genome sequence data of Chromobacterium violaceum WCH4, a human pathogenic strain from Sabah, Malaysia.
PMID:34805463
Drug-target interaction prediction using unifying of graph regularized nuclear norm with bilinear factorization.
PMID:34789169
DeepStack-DTIs: Predicting Drug-Target Interactions Using LightGBM Feature Selection and Deep-Stacked Ensemble Classifier.
PMID:34731411
Graph representation learning for structural proteomics.
PMID:34665257
Hierarchical Pooling in Graph Neural Networks to Enhance Classification Performance in Large Datasets.
PMID:34577277
DTi2Vec: Drug-target interaction prediction using network embedding and ensemble learning.
PMID:34551818
Prediction of Drug-Target Interactions by Combining Dual-Tree Complex Wavelet Transform with Ensemble Learning Method.
PMID:34500792
Multimorbidity prediction using link prediction.
PMID:34385524
Predicting Drug-Target Interactions Based on the Ensemble Models of Multiple Feature Pairs.
PMID:34202954
Secretome Analysis of Arabidopsis-Trichoderma atroviride Interaction Unveils New Roles for the Plant Glutamate:Glyoxylate Aminotransferase GGAT1 in Plant Growth Induced by the Fungus and Resistance against Botrytis cinerea.
PMID:34202732
An Ensemble Learning-Based Method for Inferring Drug-Target Interactions Combining Protein Sequences and Drug Fingerprints.
PMID:33987446
HCGA: Highly comparative graph analysis for network phenotyping.
PMID:33982022
Predicted Metabolic Function of the Gut Microbiota of Drosophila melanogaster.
PMID:33947801
Genome and Pangenome Analysis of Lactobacillus hilgardii FLUB-A New Strain Isolated from Mead.
PMID:33917427
Drug-Target Interaction Prediction via Dual Laplacian Graph Regularized Logistic Matrix Factorization.
PMID:33855072
A review on compound-protein interaction prediction methods: Data, format, representation and model.
PMID:33841755
PreDTIs: prediction of drug-target interactions based on multiple feature information using gradient boosting framework with data balancing and feature selection techniques.
PMID:33709119
Molecular basis for protein-protein interactions.
PMID:33488826
Personalized Genome-Scale Metabolic Models Identify Targets of Redox Metabolism in Radiation-Resistant Tumors.
PMID:33476554
An efficient computational method for predicting drug-target interactions using weighted extreme learning machine and speed up robot features.
PMID:33472664
A review of computational drug repositioning: strategies, approaches, opportunities, challenges, and directions.
PMID:33431024
Ensemble Learning Prediction of Drug-Target Interactions Using GIST Descriptor Extracted from PSSM-Based Evolutionary Information.
PMID:32908888
Kinetic profiling of metabolic specialists demonstrates stability and consistency of in vivo enzyme turnover numbers.
PMID:32873645
Model-driven analysis of mutant fitness experiments improves genome-scale metabolic models of Zymomonas mobilis ZM4.
PMID:32804944
Drug-target interactions prediction using marginalized denoising model on heterogeneous networks.
PMID:32703151
Impact of Facultative Bacteria on the Metabolic Function of an Obligate Insect-Bacterial Symbiosis.
PMID:32665268
Transcriptional Sequencing and Gene Expression Analysis of Various Genes in Fruit Development of Three Different Black Pepper (Piper nigrum L.) Varieties.
PMID:32399475
Gene-Wise Burden of Coding Variants Correlates to Noncoding Pharmacogenetic Risk Variants.
PMID:32349395
Genome-Scale Investigation of the Metabolic Determinants Generating Bacterial Fastidious Growth.
PMID:32234775
In silico Metabolic Pathway Analysis Identifying Target Against Leishmaniasis - A Kinetic Modeling Approach.
PMID:32211028
FRnet-DTI: Deep convolutional neural network for drug-target interaction prediction.
PMID:32154410
A Multi-Task Representation Learning Architecture for Enhanced Graph Classification.
PMID:31998065
Machine learning approaches and databases for prediction of drug-target interaction: a survey paper.
PMID:31950972
Drug-target interaction prediction using Multi Graph Regularized Nuclear Norm Minimization.
PMID:31945078
Whole Genome Sequencing and Comparative Genomics of Two Nematicidal Bacillus Strains Reveals a Wide Range of Possible Virulence Factors.
PMID:31919110
Comparative analysis of differential proteome-wide protein-protein interaction network of Methanobrevibacter ruminantium M1.
PMID:31763465
The Empusa code generator and its application to GBOL, an extendable ontology for genome annotation.
PMID:31685817
Dual pathway for metabolic engineering of Escherichia coli to produce the highly valuable hydroxytyrosol.
PMID:31682615
Comparative Genomics Reveals a Well-Conserved Intrinsic Resistome in the Emerging Multidrug-Resistant Pathogen Cupriavidus gilardii.
PMID:31578249
Draft Genome Sequence of a Chryseobacterium indologenes Strain Isolated from a Blood Culture of a Hospitalized Child in Antananarivo, Madagascar.
PMID:31467100
Drug-Target Interaction Prediction Based on Drug Fingerprint Information and Protein Sequence.
PMID:31430892
Deep learning enables high-quality and high-throughput prediction of enzyme commission numbers.
PMID:31221760
NRLMFβ: Beta-distribution-rescored neighborhood regularized logistic matrix factorization for improving the performance of drug-target interaction prediction.
PMID:30793050
Drug-Target Interaction Prediction via Dual Laplacian Graph Regularized Matrix Completion.
PMID:30627536
Integration of enzymatic data in Bacillus subtilis genome-scale metabolic model improves phenotype predictions and enables in silico design of poly-γ-glutamic acid production strains.
PMID:30626384
BRENDA in 2019: a European ELIXIR core data resource.
PMID:30395242
A new chemoinformatics approach with improved strategies for effective predictions of potential drugs.
PMID:30311095
FLIM-MAP: Gene Context Based Identification of Functional Modules in Bacterial Metabolic Pathways.
PMID:30283416
Integrated human-virus metabolic stoichiometric modelling predicts host-based antiviral targets against Chikungunya, Dengue and Zika viruses.
PMID:30209043
A Review of Dynamic Modeling Approaches and Their Application in Computational Strain Optimization for Metabolic Engineering.
PMID:30108559
Characterization of esterase activity from an Acetomicrobium hydrogeniformans enzyme with high structural stability in extreme conditions.
PMID:30014242
DMPy: a Python package for automated mathematical model construction of large-scale metabolic systems.
PMID:29914475
A physical model of cell metabolism.
PMID:29844352
Selenium-Dependent Antioxidant Enzymes: Actions and Properties of Selenoproteins.
PMID:29758013
An Integrated Approach of Proteomics and Computational Genetic Modification Effectiveness Analysis to Uncover the Mechanisms of Flood Tolerance in Soybeans.
PMID:29701710
Structural and functional characterization of the Vindoline biosynthesis pathway enzymes of Catharanthus roseus.
PMID:29442186
Open-source chemogenomic data-driven algorithms for predicting drug-target interactions.
PMID:29420684
Structure-guided design of Serratia marcescens short-chain dehydrogenase/reductase for stereoselective synthesis of (R)-phenylephrine.
PMID:29396495
iDTI-ESBoost: Identification of Drug Target Interaction Using Evolutionary and Structural Features with Boosting.
PMID:29255285
Reconstruction of Oryza sativa indica Genome Scale Metabolic Model and Its Responses to Varying RuBisCO Activity, Light Intensity, and Enzymatic Cost Conditions.
PMID:29250098
Drug-Target Interaction Prediction through Label Propagation with Linear Neighborhood Information.
PMID:29186828
DDR: efficient computational method to predict drug-target interactions using graph mining and machine learning approaches.
PMID:29186331
Genome-scale modeling and transcriptome analysis of Leuconostoc mesenteroides unravel the redox governed metabolic states in obligate heterofermentative lactic acid bacteria.
PMID:29147021
Metabolomic Modularity Analysis (MMA) to Quantify Human Liver Perfusion Dynamics.
PMID:29137180
In silico prediction of drug-target interaction networks based on drug chemical structure and protein sequences.
PMID:28894115
Aspergillus niger Secretes Citrate to Increase Iron Bioavailability.
PMID:28824560
Genome-Scale Modeling of NADPH-Driven β-Lapachone Sensitization in Head and Neck Squamous Cell Carcinoma.
PMID:28762750
Prediction of Drug-Target Interaction Networks from the Integration of Protein Sequences and Drug Chemical Structures.
PMID:28678206
Detecting similar binding pockets to enable systems polypharmacology.
PMID:28662117
Drug repositioning for enzyme modulator based on human metabolite-likeness.
PMID:28617219
BacArena: Individual-based metabolic modeling of heterogeneous microbes in complex communities.
PMID:28531184
Pioneering topological methods for network-based drug-target prediction by exploiting a brain-network self-organization theory.
PMID:28453640
Cooperative Metabolism in a Three-Partner Insect-Bacterial Symbiosis Revealed by Metabolic Modeling.
PMID:28348026
SELF-BLM: Prediction of drug-target interactions via self-training SVM.
PMID:28192537
Design principles of autocatalytic cycles constrain enzyme kinetics and force low substrate saturation at flux branch points.
PMID:28169831
Predicting drug-target interactions by dual-network integrated logistic matrix factorization.
PMID:28079135
Metagenomic mining for thermostable esterolytic enzymes uncovers a new family of bacterial esterases.
PMID:27991516
Community metabolic modeling approaches to understanding the gut microbiome: Bridging biochemistry and ecology.
PMID:27989793
EstDZ3: A New Esterolytic Enzyme Exhibiting Remarkable Thermostability.
PMID:27899916
The Protein Cost of Metabolic Fluxes: Prediction from Enzymatic Rate Laws and Cost Minimization.
PMID:27812109
Loss of variation of state detected in soybean metabolic and human myelomonocytic leukaemia cell transcriptional networks under external stimuli.
PMID:27775018
In Vivo Analysis of NH4+ Transport and Central Nitrogen Metabolism in Saccharomyces cerevisiae during Aerobic Nitrogen-Limited Growth.
PMID:27637876
Gene Ontology synonym generation rules lead to increased performance in biomedical concept recognition.
PMID:27613112
The Need for Integrated Approaches in Metabolic Engineering.
PMID:27527588
Linking Bacillus cereus Genotypes and Carbohydrate Utilization Capacity.
PMID:27272929
Oligomerization as a strategy for cold adaptation: Structure and dynamics of the GH1 β-glucosidase from Exiguobacterium antarcticum B7.
PMID:27029646
A comparative study of SMILES-based compound similarity functions for drug-target interaction prediction.
PMID:26987649
DASPfind: new efficient method to predict drug-target interactions.
PMID:26985240
Systems biology of the structural proteome.
PMID:26969117
Global characterization of in vivo enzyme catalytic rates and their correspondence to in vitro kcat measurements.
PMID:26951675
Neighborhood Regularized Logistic Matrix Factorization for Drug-Target Interaction Prediction.
PMID:26872142
Improved prediction of drug-target interactions using regularized least squares integrating with kernel fusion technique.
PMID:26851083
A multiple kernel learning algorithm for drug-target interaction prediction.
PMID:26801218
A Glimpse to Background and Characteristics of Major Molecular Biological Networks.
PMID:26491677
Revisiting the chlorophyll biosynthesis pathway using genome scale metabolic model of Oryza sativa japonica.
PMID:26443104
The Augmenting Effects of Desolvation and Conformational Energy Terms on the Predictions of Docking Programs against mPGES-1.
PMID:26305898
Microbial Communities Can Be Described by Metabolic Structure: A General Framework and Application to a Seasonally Variable, Depth-Stratified Microbial Community from the Coastal West Antarctic Peninsula.
PMID:26285202
PINGU: PredIction of eNzyme catalytic residues usinG seqUence information.
PMID:26261982
Deciding when to stop: efficient experimentation to learn to predict drug-target interactions.
PMID:26153434
Cooperative Electrostatic Interactions Drive Functional Evolution in the Alkaline Phosphatase Superfamily.
PMID:26091851
HIGH-PRECISION BIOLOGICAL EVENT EXTRACTION: EFFECTS OF SYSTEM AND OF DATA.
PMID:25937701
Determining similarity of scientific entities in annotation datasets.
PMID:25725057
Genome-scale modeling for metabolic engineering.
PMID:25578304
Predictive sulfur metabolism - a field in flux.
PMID:25477892
TrypanoCyc: a community-led biochemical pathways database for Trypanosoma brucei.
PMID:25300491
Multi-tissue computational modeling analyzes pathophysiology of type 2 diabetes in MKR mice.
PMID:25029527
Identification of key regulators in glycogen utilization in E. coli based on the simulations from a hybrid functional Petri net model.
PMID:24565082
Drug repositioning by kernel-based integration of molecular structure, molecular activity, and phenotype data.
PMID:24244318
Manipulating the sleeping beauty mutase operon for the production of 1-propanol in engineered Escherichia coli.
PMID:24074355
Protonation and pK changes in protein-ligand binding.
PMID:23889892
Predicting Drug-Target Interactions for New Drug Compounds Using a Weighted Nearest Neighbor Profile.
PMID:23840562
Application of Top-Down and Bottom-up Systems Approaches in Ruminant Physiology and Metabolism.
PMID:23372424
Sharing and re-use of phylogenetic trees (and associated data) to facilitate synthesis.
PMID:23088596
Erythrocytic stage-dependent regulation of oligomerization of Plasmodium ribosomal protein P2.
PMID:23060439
Shrinking the metabolic solution space using experimental datasets.
PMID:22956899
MuteinDB: the mutein database linking substrates, products and enzymatic reactions directly with genetic variants of enzymes.
PMID:22730453
Analyzing large biological datasets with association networks.
PMID:22638576
Prediction of drug-target interactions and drug repositioning via network-based inference.
PMID:22589709
High similarity of phylogenetic profiles of rate-limiting enzymes with inhibitory relation in Human, Mouse, Rat, budding Yeast and E. coli.
PMID:22369203
In silico insights into the symbiotic nitrogen fixation in Sinorhizobium meliloti via metabolic reconstruction.
PMID:22319621
Bioinformatic Analysis of Leishmania donovani Long-Chain Fatty Acid-CoA Ligase as a Novel Drug Target.
PMID:22091399
Bioinformatics and systems biology of the lipidome.
PMID:21939287
Integrative analysis of transgenic alfalfa (Medicago sativa L.) suggests new metabolic control mechanisms for monolignol biosynthesis.
PMID:21625579
Exploring the metabolic network of the epidemic pathogen Burkholderia cenocepacia J2315 via genome-scale reconstruction.
PMID:21609491
Characterizing the complexity of enzymes on the basis of their mechanisms and structures with a bio-computational analysis.
PMID:21605342
Caught in self-interaction: evolutionary and functional mechanisms of protein homooligomerization.
PMID:21572178
Genome-scale metabolic modeling elucidates the role of proliferative adaptation in causing the Warburg effect.
PMID:21423717
Bacterial protein structures reveal phylum dependent divergence.
PMID:21315656
Searching the protein structure database for ligand-binding site similarities using CPASS v.2.
PMID:21269480
Parameter balancing in kinetic models of cell metabolism.
PMID:21038890
The BRENDA Tissue Ontology (BTO): the first all-integrating ontology of all organisms for enzyme sources.
PMID:21030441
An atlas of bovine gene expression reveals novel distinctive tissue characteristics and evidence for improving genome annotation.
PMID:20961407
Detecting variants with Metabolic Design, a new software tool to design probes for explorative functional DNA microarray development.
PMID:20860850
Computational systems chemical biology.
PMID:20838980
KID--an algorithm for fast and efficient text mining used to automatically generate a database containing kinetic information of enzymes.
PMID:20626859
Characterization of growth and metabolism of the haloalkaliphile Natronomonas pharaonis.
PMID:20543878
Drug-target interaction prediction from chemical, genomic and pharmacological data in an integrated framework.
PMID:20529913
Metabolic pathway relationships revealed by an integrative analysis of the transcriptional and metabolic temperature stress-response dynamics in yeast.
PMID:20455750
BiGG: a Biochemical Genetic and Genomic knowledgebase of large scale metabolic reconstructions.
PMID:20426874
Quantitative global studies of reactomes and metabolomes using a vectorial representation of reactions and chemical compounds.
PMID:20406431
The smallest chemical reaction system with bistability.
PMID:19737387
Development and validation of a species-independent functional gene microarray that targets lactic acid bacteria.
PMID:19684161
Supervised prediction of drug-target interactions using bipartite local models.
PMID:19605421
A mathematical model to derive N-glycan structures and cellular enzyme activities from mass spectrometric data.
PMID:19506293
Stochasticity in protein levels drives colinearity of gene order in metabolic operons of Escherichia coli.
PMID:19492041
An integrated model of eicosanoid metabolism and signaling based on lipidomics flux analysis.
PMID:19486676
MirZ: an integrated microRNA expression atlas and target prediction resource.
PMID:19468042
A theoretical model for template-free synthesis of long DNA sequence.
PMID:19343541
Recent developments in parameter estimation and structure identification of biochemical and genomic systems.
PMID:19327372
Modeling metabolic networks in C. glutamicum: a comparison of rate laws in combination with various parameter optimization strategies.
PMID:19144170
Questioning the ubiquity of neofunctionalization.
PMID:19119408
Reconstruction of biochemical networks in microorganisms.
PMID:19116616
BRENDA, AMENDA and FRENDA the enzyme information system: new content and tools in 2009.
PMID:18984617
ExplorEnz: the primary source of the IUBMB enzyme list.
PMID:18776214
Genome-scale model for Clostridium acetobutylicum: Part I. Metabolic network resolution and analysis.
PMID:18767192
Histoplasma capsulatum secreted gamma-glutamyltransferase reduces iron by generating an efficient ferric reductant.
PMID:18761625
Built-in loops allow versatility in domain-domain interactions: lessons from self-interacting domains.
PMID:18757736
Evolutionarily conserved substrate substructures for automated annotation of enzyme superfamilies.
PMID:18670595
Metabolic network fluxes in heterotrophic Arabidopsis cells: stability of the flux distribution under different oxygenation conditions.
PMID:18667721
Metal ions in biological catalysis: from enzyme databases to general principles.
PMID:18604568
Prediction of drug-target interaction networks from the integration of chemical and genomic spaces.
PMID:18586719
Phototroph genomics ten years on.
PMID:18568416
Inferring modules of functionally interacting proteins using the Bond Energy Algorithm.
PMID:18559112
Blast2GO: A comprehensive suite for functional analysis in plant genomics.
PMID:18483572
SBMLsqueezer: a CellDesigner plug-in to generate kinetic rate equations for biochemical networks.
PMID:18447902
Metabolic pathways of the wheat (Triticum aestivum) endosperm amyloplast revealed by proteomics.
PMID:18419817
Extremely thermostable esterases from the thermoacidophilic euryarchaeon Picrophilus torridus.
PMID:18330499
Replacement of the arginine biosynthesis operon in Xanthomonadales by lateral gene transfer.
PMID:18305979
Prediction of enzymes and non-enzymes from protein sequences based on sequence derived features and PSSM matrix using artificial neural network.
PMID:18288334
Thiamine biosynthesis in algae is regulated by riboswitches.
PMID:18093957
Quantitative systems-level determinants of human genes targeted by successful drugs.
PMID:18083776
PRIDE: new developments and new datasets.
PMID:18033805
A fault model for ontology mapping, alignment, and linking systems.
PMID:17990495
Identifying the subproteome of kinetically stable proteins via diagonal 2D SDS/PAGE.
PMID:17956990
Visualizing regulatory interactions in metabolic networks.
PMID:17939866
qPIPSA: relating enzymatic kinetic parameters and interaction fields.
PMID:17919319
PAZAR: a framework for collection and dissemination of cis-regulatory sequence annotation.
PMID:17916232
ExplorEnz: a MySQL database of the IUBMB enzyme nomenclature.
PMID:17662133
Applying negative rule mining to improve genome annotation.
PMID:17659089
Systems chemical biology.
PMID:17637771
Integrative content-driven concepts for bioinformatics "beyond the cell".
PMID:17426389
METANNOGEN: compiling features of biochemical reactions needed for the reconstruction of metabolic networks.
PMID:17408512
Regulation of metabolic networks by small molecule metabolites.
PMID:17352833
A network perspective on the evolution of metabolism by gene duplication.
PMID:17326820
Global reconstruction of the human metabolic network based on genomic and bibliomic data.
PMID:17267599
SYSTOMONAS--an integrated database for systems biology analysis of Pseudomonas.
PMID:17202169
BRENDA, AMENDA and FRENDA: the enzyme information system in 2007.
PMID:17202167
Bringing metabolic networks to life: integration of kinetic, metabolic, and proteomic data.
PMID:17173670
Bringing metabolic networks to life: convenience rate law and thermodynamic constraints.
PMID:17173669
PduL is an evolutionarily distinct phosphotransacylase involved in B12-dependent 1,2-propanediol degradation by Salmonella enterica serovar typhimurium LT2.
PMID:17158662
Correcting ligands, metabolites, and pathways.
PMID:17132165
Parameter estimate of signal transduction pathways.
PMID:17118160
Evaluation of lexical methods for detecting relationships between concepts from multiple ontologies.
PMID:17094225
MACiE (Mechanism, Annotation and Classification in Enzymes): novel tools for searching catalytic mechanisms.
PMID:17082206
Meta-All: a system for managing metabolic pathway information.
PMID:17059592
ORENZA: a web resource for studying ORphan ENZyme activities.
PMID:17026747
ProSAT2--Protein Structure Annotation Server.
PMID:16845114
Accelerating the reconstruction of genome-scale metabolic networks.
PMID:16772023
Living with genome instability: the adaptation of phytoplasmas to diverse environments of their insect and plant hosts.
PMID:16672622
Predicting genes for orphan metabolic activities using phylogenetic profiles.
PMID:16507154
Escherichia coli K-12: a cooperatively developed annotation snapshot--2005.
PMID:16397293
EndoNet: an information resource about endocrine networks.
PMID:16381928
MODOMICS: a database of RNA modification pathways.
PMID:16381833
EHPred: an SVM-based method for epoxide hydrolases recognition and classification.
PMID:16365918
Structural characterization of glucooligosaccharide oxidase from Acremonium strictum.
PMID:16332885
In silico reconstruction of the metabolic pathways of Lactobacillus plantarum: comparing predictions of nutrient requirements with those from growth experiments.
PMID:16269766
MACiE: a database of enzyme reaction mechanisms.
PMID:16188925
metaSHARK: software for automated metabolic network prediction from DNA sequence and its application to the genomes of Plasmodium falciparum and Eimeria tenella.
PMID:15745999
SNPeffect: a database mapping molecular phenotypic effects of human non-synonymous coding SNPs.
PMID:15608254
IdentiCS--identification of coding sequence and in silico reconstruction of the metabolic network directly from unannotated low-coverage bacterial genome sequence.
PMID:15312235
Retrieving sequences of enzymes experimentally characterized but erroneously annotated : the case of the putrescine carbamoyltransferase.
PMID:15287962
Potential use of sugar binding proteins in reactors for regeneration of CO2 fixation acceptor D-Ribulose-1,5-bisphosphate.
PMID:15175111