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Drug Effect Prediction by Polypharmacology-Based Interaction Profiling
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1002/cmdc.200700026openalex-snapshot
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inferredcites →https://doi.org/10.1002/jcc.20634openalex-snapshot
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inferredcites →https://doi.org/10.1002/prot.20497openalex-snapshot
Comparing protein–ligand docking programs is difficult
inferredcites →https://doi.org/10.1002/prot.21183openalex-snapshot
Critical assessment of the automated AutoDock as a new docking tool for virtual screening
inferredcites →https://doi.org/10.1016/1074-5521(95)90283-xopenalex-snapshot
Predicting ligand binding to proteins by affinity fingerprinting
inferredcites →https://doi.org/10.1016/j.cbpa.2010.06.166openalex-snapshot
Rational approaches to targeted polypharmacology: creating and navigating protein–ligand interaction networks
inferredcites →https://doi.org/10.1016/j.drudis.2010.06.006openalex-snapshot
Drug profiling: knowing where it hits
inferredcites →https://doi.org/10.1016/j.sbi.2006.01.013openalex-snapshot
Can we rationally design promiscuous drugs?
inferredcites →https://doi.org/10.1016/j.tips.2009.11.006openalex-snapshot
Unveiling the role of network and systems biology in drug discovery
inferredcites →https://doi.org/10.1016/s0378-4347(98)00045-0openalex-snapshot
Protein affinity map of chemical space
inferredcites →https://doi.org/10.1021/ci034052uopenalex-snapshot
A Comprehensive Docking Study on the Selectivity of Binding of Aromatic Compounds to Proteins
inferredcites →https://doi.org/10.1021/ci600197yopenalex-snapshot
“Bayes Affinity Fingerprints” Improve Retrieval Rates in Virtual Screening and Define Orthogonal Bioactivity Space: When Are Multitarget Drugs a Feasible Concept?
inferredcites →https://doi.org/10.1021/ci600426eopenalex-snapshot
Evaluating Virtual Screening Methods: Good and Bad Metrics for the “Early Recognition” Problem
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A Critical Assessment of Docking Programs and Scoring Functions
inferredcites →https://doi.org/10.1021/jm950800yopenalex-snapshot
Molecular Similarity Based on DOCK-Generated Fingerprints
inferredcites →https://doi.org/10.1023/a:1016357811882openalex-snapshot
Further development and validation of empirical scoring functions for structure-based binding affinity prediction
inferredcites →https://doi.org/10.1038/nature08506openalex-snapshot
Predicting new molecular targets for known drugs
inferredcites →https://doi.org/10.1038/nbt1284openalex-snapshot
Relating protein pharmacology by ligand chemistry
inferredcites →https://doi.org/10.1038/nchembio747openalex-snapshot
Analysis of drug-induced effect patterns to link structure and side effects of medicines
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Magic shotguns versus magic bullets: selectively non-selective drugs for mood disorders and schizophrenia
inferredcites →https://doi.org/10.1038/nrd1468openalex-snapshot
Drug repositioning: identifying and developing new uses for existing drugs
inferredcites →https://doi.org/10.1038/sj.bjp.0707515openalex-snapshot
Towards the development of universal, fast and highly accurate docking/scoring methods: a long way to go
inferredcites →https://doi.org/10.1093/nar/gkm958openalex-snapshot
DrugBank: a knowledgebase for drugs, drug actions and drug targets
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Drug Target Identification Using Side-Effect Similarity
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Relating the shape of protein binding sites to binding affinity profiles: is there an association?
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PocketPicker: analysis of ligand binding-sites with shape descriptors
inferredcites →https://doi.org/10.1186/1752-153x-2-18openalex-snapshot
DOVIS 2.0: an efficient and easy to use parallel virtual screening tool based on AutoDock 4.0
What points at this work
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inferred← citeshttps://doi.org/10.1002/9783527674381.ch3openalex-snapshot
Repositioning of Drug – New Indications for Marketed Drugs
inferred← citeshttps://doi.org/10.1002/9783527677016.ch4openalex-snapshot
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inferred← citeshttps://doi.org/10.1002/9783527818242.ch10openalex-snapshot
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inferred← citeshttps://doi.org/10.1002/cmdc.201500123openalex-snapshot
Target Fishing by Cross‐Docking to Explain Polypharmacological Effects
inferred← citeshttps://doi.org/10.1002/cmdc.201600121openalex-snapshot
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inferred← citeshttps://doi.org/10.1002/ddr.21209openalex-snapshot
Progress in the Analysis of Multiple Activity Profile of Screening Data Using Computational Approaches
inferred← citeshttps://doi.org/10.1002/minf.201200088openalex-snapshot
Exploiting Pharmacological Similarity to Identify Safety Concerns – Listen to What the Data Tells You
inferred← citeshttps://doi.org/10.1002/minf.201400051openalex-snapshot
Compound Structure‐Independent Activity Prediction in High‐Dimensional Target Space
inferred← citeshttps://doi.org/10.1002/minf.201600013openalex-snapshot
Quantitative Structure‐activity Relationship (QSAR) Models for Docking Score Correction
inferred← citeshttps://doi.org/10.1002/minf.201700120openalex-snapshot
Prediction of Protein−compound Binding Energies from Known Activity Data: Docking‐score‐based Method and its Applications
inferred← citeshttps://doi.org/10.1007/7653_2018_9openalex-snapshot
Development of a Web-Server for Identification of Common Lead Molecules for Multiple Protein Targets
inferred← citeshttps://doi.org/10.1007/s11095-024-03742-xopenalex-snapshot
Machine Learning Prediction of On/Off Target-driven Clinical Adverse Events
inferred← citeshttps://doi.org/10.1007/s40264-018-0688-5openalex-snapshot
Predicting Adverse Drug Effects from Literature- and Database-Mined Assertions
inferred← citeshttps://doi.org/10.1016/b978-0-12-409547-2.12283-8openalex-snapshot
Drug Repurposing Review
inferred← citeshttps://doi.org/10.1016/b978-0-12-809633-8.20160-xopenalex-snapshot
Drug Repurposing and Multi-Target Therapies
inferred← citeshttps://doi.org/10.1016/bs.pmbts.2024.03.021openalex-snapshot
Novel strategies for drug repurposing
inferred← citeshttps://doi.org/10.1016/j.bmc.2012.12.041openalex-snapshot
Retrospective group fusion similarity search based on eROCE evaluation metric
inferred← citeshttps://doi.org/10.1016/j.drudis.2012.11.008openalex-snapshot
The promiscuous binding of pharmaceutical drugs and their transporter-mediated uptake into cells: what we (need to) know and how we can do so
inferred← citeshttps://doi.org/10.1016/j.medidd.2025.100220openalex-snapshot
Leveraging network pharmacology for drug discovery: Integrative approaches and emerging insights
inferred← citeshttps://doi.org/10.1016/j.pharmthera.2017.02.034openalex-snapshot
The impact of in silico screening in the discovery of novel and safer drug candidates
inferred← citeshttps://doi.org/10.1016/j.phrs.2015.08.018openalex-snapshot
Multiple binding sites in the nicotinic acetylcholine receptors: An opportunity for polypharmacolgy
inferred← citeshttps://doi.org/10.1016/j.pisc.2015.06.004openalex-snapshot
The transporter-mediated cellular uptake of pharmaceutical drugs is based on their metabolite-likeness and not on their bulk biophysical properties: Towards a systems pharmacology
inferred← citeshttps://doi.org/10.1016/s1674-6384(15)60014-4openalex-snapshot
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inferred← citeshttps://doi.org/10.1021/acs.jcim.0c00110openalex-snapshot
cando.py: Open Source Software for Predictive Bioanalytics of Large Scale Drug–Protein–Disease Data
inferred← citeshttps://doi.org/10.1021/acs.jcim.5b00120openalex-snapshot
GESSE: Predicting Drug Side Effects from Drug–Target Relationships
inferred← citeshttps://doi.org/10.1021/ci3001056openalex-snapshot
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inferred← citeshttps://doi.org/10.1021/ci3004489openalex-snapshot
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inferred← citeshttps://doi.org/10.1021/ci300607ropenalex-snapshot
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inferred← citeshttps://doi.org/10.1021/ci4006723openalex-snapshot
GES Polypharmacology Fingerprints: A Novel Approach for Drug Repositioning
inferred← citeshttps://doi.org/10.1021/ci500092jopenalex-snapshot
Curation and Analysis of Multitargeting Agents for Polypharmacological Modeling
inferred← citeshttps://doi.org/10.1021/jm400813yopenalex-snapshot
Experimental Confirmation of New Drug–Target Interactions Predicted by Drug Profile Matching
inferred← citeshttps://doi.org/10.1021/jm5006463openalex-snapshot
Polypharmacology: Challenges and Opportunities in Drug Discovery
inferred← citeshttps://doi.org/10.1039/d3md00038aopenalex-snapshot
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inferred← citeshttps://doi.org/10.1080/08927022.2014.899699openalex-snapshot
Polypharmacology and supercomputer-based docking: opportunities and challenges
inferred← citeshttps://doi.org/10.1093/bioinformatics/btt279openalex-snapshot
DrugMap Central: an on-line query and visualization tool to facilitate drug repositioning studies
inferred← citeshttps://doi.org/10.1109/tem.2022.3187989openalex-snapshot
Research on Potential Adverse Drug Reaction Forecasting Based on SAO Semantic Structure
inferred← citeshttps://doi.org/10.1111/bph.12294openalex-snapshot
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inferred← citeshttps://doi.org/10.1111/cbdd.12294openalex-snapshot
Modeling of Compound Profiling Experiments Using Support Vector Machines
inferred← citeshttps://doi.org/10.1111/cbdd.12578openalex-snapshot
Identification of Orthologous Target Pairs with Shared Active Compounds and Comparison of Organism‐specific Activity Patterns
inferred← citeshttps://doi.org/10.1111/febs.12268openalex-snapshot
Finding novel pharmaceuticals in the systems biology era using multiple effective drug targets, phenotypic screening and knowledge of transporters: where drug discovery went wrong and how to fix it
inferred← citeshttps://doi.org/10.1155/2016/6378137openalex-snapshot
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inferred← citeshttps://doi.org/10.1186/s13321-015-0071-9openalex-snapshot
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inferred← citeshttps://doi.org/10.1186/s13321-015-0110-6openalex-snapshot
Accurate and efficient target prediction using a potency-sensitive influence-relevance voter
inferred← citeshttps://doi.org/10.1186/s13321-020-00444-5openalex-snapshot
QSAR-derived affinity fingerprints (part 2): modeling performance for potency prediction
inferred← citeshttps://doi.org/10.1515/cppm-2013-0041openalex-snapshot
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inferred← citeshttps://doi.org/10.1517/17460441.2015.1082543openalex-snapshot
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inferred← citeshttps://doi.org/10.1586/ecp.12.74openalex-snapshot
Polypharmacology: drug discovery for the future
inferred← citeshttps://doi.org/10.17615/z65y-xj23openalex-snapshot
Predicting Adverse Drug Effects from Literature Assertions that Link Drugs to Targets and Targets to Effects
inferred← citeshttps://doi.org/10.17863/cam.8362openalex-snapshot
Target Fishing: A Single-Label or Multi-Label Problem?
inferred← citeshttps://doi.org/10.2147/dddt.s47173openalex-snapshot
Identification of PPARγ ligands with One-dimensional Drug Profile Matching
inferred← citeshttps://doi.org/10.2174/0115680266264206231020111820openalex-snapshot
Recent Development in the Search for Epidermal Growth Factor Receptor (EGFR) Inhibitors based on the Indole Pharmacophore
inferred← citeshttps://doi.org/10.2174/1381612822666160224142812openalex-snapshot
Polypharmacology in Drug Discovery: A Review from Systems Pharmacology Perspective
inferred← citeshttps://doi.org/10.2174/15680266113139990028openalex-snapshot
Recent Trends and Future Prospects in Computational GPCR Drug Discovery: From Virtual Screening to Polypharmacology
inferred← citeshttps://doi.org/10.33015/dominican.edu/2015.bio.05openalex-snapshot
Modeling Uric Acid Kidney Stones Disease in D. melanogaster using RNAi and Dietary Modulation
inferred← citeshttps://doi.org/10.3390/molecules25225425openalex-snapshot
Targeting Beta-Blocker Drug–Drug Interactions with Fibrinogen Blood Plasma Protein: A Computational and Experimental Study
inferred← citeshttps://doi.org/10.3390/pharmaceutics12090879openalex-snapshot
Uncovering New Drug Properties in Target-Based Drug–Drug Similarity Networks
inferred← citeshttps://doi.org/10.4103/2225-4110.124323openalex-snapshot
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inferred← citeshttps://doi.org/10.4172/2469-9853.1000116openalex-snapshot
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inferred← citeshttps://doi.org/10.5505/turkhijyen.2019.33576openalex-snapshot
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inferred← citeshttps://doi.org/10.5772/53868openalex-snapshot
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inferred← citeshttps://doi.org/10.5897/ajb2016.15709openalex-snapshot
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inferred← citeshttps://doi.org/10.6084/m9.figshare.12617895openalex-snapshot
Additional file 1 of QSAR-derived affinity fingerprints (part 2): modeling performance for potency prediction
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