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Kinase-Targeted Library Design through the Application of the PharmPrint Methodology

https://doi.org/10.1021/ci800276t
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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1007/s10822-005-9002-6openalex-snapshot
Surrogate docking: structure-based virtual screening at high throughput speed
inferredcites →https://doi.org/10.1016/j.bmc.2005.06.026openalex-snapshot
Combinatorial design of nonsymmetrical cyclic urea inhibitors of aspartic protease of HIV-1
inferredcites →https://doi.org/10.1016/j.bmcl.2005.10.065openalex-snapshot
In silico design and synthesis of piperazine-1-pyrrolidine-2,5-dione scaffold-based novel malic enzyme inhibitors
inferredcites →https://doi.org/10.1021/cc049866hopenalex-snapshot
Focused Combinatorial Library Design Based on Structural Diversity, Druglikeness and Binding Affinity Score
inferredcites →https://doi.org/10.1021/ci0340658openalex-snapshot
On the Physical Interpretation of QSAR Models
inferredcites →https://doi.org/10.1021/ci049692ropenalex-snapshot
Combinatorial Ligand Design Targeted at Protein Families
inferredcites →https://doi.org/10.1021/ci049803mopenalex-snapshot
Comparing Ligand Interactions with Multiple Receptors via Serial Docking
inferredcites →https://doi.org/10.1021/ci0498968openalex-snapshot
Application of the PharmPrint Methodology to Two Protein Kinases
inferredcites →https://doi.org/10.1021/ci050407topenalex-snapshot
Ligand Bias of Scoring Functions in Structure-Based Virtual Screening
inferredcites →https://doi.org/10.1021/ci980008gopenalex-snapshot
Evaluation of Quantitative Structure−Activity Relationship Methods for Large-Scale Prediction of Chemicals Binding to the Estrogen Receptor
inferredcites →https://doi.org/10.1021/ci980159jopenalex-snapshot
Pharmacophore Fingerprinting. 1. Application to QSAR and Focused Library Design
inferredcites →https://doi.org/10.1021/ci990313hopenalex-snapshot
Pharmacophore Fingerprinting. 2. Application to Primary Library Design
inferredcites →https://doi.org/10.1021/ja003972fopenalex-snapshot
Use of MCSS to Design Small Targeted Libraries: Application to Picornavirus Ligands
inferredcites →https://doi.org/10.1021/jm020495yopenalex-snapshot
Novel Dihydrofolate Reductase Inhibitors. Structure-Based versus Diversity-Based Library Design and High-Throughput Synthesis and Screening
inferredcites →https://doi.org/10.1021/jm048962uopenalex-snapshot
Virtual Docking Approaches to Protein Kinase B Inhibition
inferredcites →https://doi.org/10.1021/jm050063yopenalex-snapshot
Design of Small-Sized Libraries by Combinatorial Assembly of Linkers and Functional Groups to a Given Scaffold: Application to the Structure-Based Optimization of a Phosphodiesterase 4 Inhibitor
inferredcites →https://doi.org/10.1021/jm050381xopenalex-snapshot
Knowledge-Based Design of Target-Focused Libraries Using Protein−Ligand Interaction Constraints
inferredcites →https://doi.org/10.1021/jm050504dopenalex-snapshot
Comparative Virtual and Experimental High-Throughput Screening for Glycogen Synthase Kinase-3β Inhibitors
inferredcites →https://doi.org/10.1021/jm050554iopenalex-snapshot
Protein Structures in Virtual Screening: A Case Study with CDK2
inferredcites →https://doi.org/10.1023/a:1008036704754openalex-snapshot
CombiDOCK: Structure-based combinatorial docking and library design
inferredcites →https://doi.org/10.1023/a:1025386326946openalex-snapshot
Rational selection of training and test sets for the development of validated QSAR models
inferredcites →https://doi.org/10.1039/9781847552556openalex-snapshot
Exploiting Chemical Diversity for Drug Discovery
inferredcites →https://doi.org/10.1080/00268970210144277openalex-snapshot
Application of computer assisted combinatorial chemistry in antivirial, antimalarial and anticancer agents design
inferredcites →https://doi.org/10.1385/1-59259-802-1:335openalex-snapshot
Designing Combinatorial Libraries Optimized on Multiple Objectives

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.1002/chin.200916213openalex-snapshot
ChemInform Abstract: Kinase‐Targeted Library Design Through the Application of the PharmPrint Methodology.
inferred← citeshttps://doi.org/10.1007/978-1-60761-839-3_16openalex-snapshot
Methods for Combinatorial and Parallel Library Design
inferred← citeshttps://doi.org/10.1007/978-1-60761-839-3_17openalex-snapshot
The Interweaving of Cheminformatics and HTS
inferred← citeshttps://doi.org/10.1007/s11095-010-0065-2openalex-snapshot
In-Silico Approaches to Multi-target Drug Discovery
inferred← citeshttps://doi.org/10.1016/b978-0-08-099420-8.00003-1openalex-snapshot
Step IIIa: Biological Hit Discovery Through High-Throughput Screening (HTS): Random Approaches and Rational Design
inferred← citeshttps://doi.org/10.1016/j.bbapap.2009.12.002openalex-snapshot
Structure-guided expansion of kinase fragment libraries driven by support vector machine models
inferred← citeshttps://doi.org/10.1016/j.cbpa.2010.03.024openalex-snapshot
Enhancements of screening collections to address areas of unmet medical need: an industry perspective
inferred← citeshttps://doi.org/10.1016/j.jmgm.2010.01.007openalex-snapshot
A comprehensive structure–activity analysis of protein kinase B-alpha (Akt1) inhibitors
inferred← citeshttps://doi.org/10.1021/cb300729yopenalex-snapshot
De Novo Design of Protein Kinase Inhibitors by in Silico Identification of Hinge Region-Binding Fragments
inferred← citeshttps://doi.org/10.1021/jm101195aopenalex-snapshot
Trends in Kinase Selectivity: Insights for Target Class-Focused Library Screening
inferred← citeshttps://doi.org/10.1021/jm901147eopenalex-snapshot
Kinase Inhibitor Data Modeling and de Novo Inhibitor Design with Fragment Approaches
inferred← citeshttps://doi.org/10.1021/mp100179topenalex-snapshot
Virtual Screening of Selective Multitarget Kinase Inhibitors by Combinatorial Support Vector Machines
inferred← citeshttps://doi.org/10.1039/c5md00253bopenalex-snapshot
Property-based characterization of kinase-like ligand space for library design and virtual screening
inferred← citeshttps://doi.org/10.1186/1758-2946-4-4openalex-snapshot
A physicochemical descriptor-based scoring scheme for effective and rapid filtering of kinase-like chemical space
inferred← citeshttps://doi.org/10.2174/1568026619666191116160326openalex-snapshot
Pharmacophore Modeling, Synthesis, Scaffold Hopping and Biological β- Hematin Inhibition Interaction Studies for Anti-malaria Compounds
inferred← citeshttps://doi.org/10.3390/molecules25040938openalex-snapshot
Large-Scale Virtual Screening Against the MET Kinase Domain Identifies a New Putative Inhibitor Type
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