FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2014678042> ?p ?o ?g. }

• W2014678042 endingPage "436" @default.
• W2014678042 startingPage "425" @default.
• W2014678042 abstract "Bioisosteric replacements are commonly understood to be replacements of groups of atoms in bioactive compounds that retain their specific activity and retain, or further improve, compound potency. Such chemical modifications are of high interest in medicinal chemistry and are often considered in compound exploration and optimization.We have applied the matched molecular pair formalism to carry out a large-scale data mining study to identify bioisosteres in publicly available active compounds with similar potency. Our data mining effort has identified a set of 96 nonredundant bioisosteric replacements, approximately half of which were previously unobserved. However, a number of replacements commonly considered to be bioisosteric did not meet our extended bioisostere selection criteria, which included high frequency of occurrence, limited potency alterations and activity across different target families. Furthermore, many commonly known bioisosteric replacements were found to be dependent on the structural context in which they occurred.The systematic analysis of public domain compound data presented herein provides an alternative route to the identification of bioisosteric replacements and further extends the spectrum of currently known bioisosteres. We provide a compendium of bioisosteric replacements that are well supported by currently available compound data." @default.
• W2014678042 created "2016-06-24" @default.
• W2014678042 creator A5023868486 @default.
• W2014678042 creator A5039926688 @default.
• W2014678042 date "2011-03-01" @default.
• W2014678042 modified "2023-09-24" @default.
• W2014678042 title "Large-scale exploration of bioisosteric replacements on the basis of matched molecular pairs" @default.
• W2014678042 cites W1604884792 @default.
• W2014678042 cites W1992605554 @default.
• W2014678042 cites W2005518172 @default.
• W2014678042 cites W2018621056 @default.
• W2014678042 cites W2060531713 @default.
• W2014678042 cites W2065651723 @default.
• W2014678042 cites W2070505319 @default.
• W2014678042 cites W2085313140 @default.
• W2014678042 cites W2085379340 @default.
• W2014678042 cites W2095344112 @default.
• W2014678042 cites W2097475255 @default.
• W2014678042 cites W4211208250 @default.
• W2014678042 cites W4232387065 @default.
• W2014678042 cites W4254110724 @default.
• W2014678042 doi "https://doi.org/10.4155/fmc.10.293" @default.
• W2014678042 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/21452979" @default.
• W2014678042 hasPublicationYear "2011" @default.
• W2014678042 type Work @default.
• W2014678042 sameAs 2014678042 @default.
• W2014678042 citedByCount "48" @default.
• W2014678042 countsByYear W20146780422012 @default.
• W2014678042 countsByYear W20146780422013 @default.
• W2014678042 countsByYear W20146780422014 @default.
• W2014678042 countsByYear W20146780422015 @default.
• W2014678042 countsByYear W20146780422016 @default.
• W2014678042 countsByYear W20146780422017 @default.
• W2014678042 countsByYear W20146780422018 @default.
• W2014678042 countsByYear W20146780422019 @default.
• W2014678042 countsByYear W20146780422020 @default.
• W2014678042 countsByYear W20146780422021 @default.
• W2014678042 countsByYear W20146780422022 @default.
• W2014678042 countsByYear W20146780422023 @default.
• W2014678042 crossrefType "journal-article" @default.
• W2014678042 hasAuthorship W2014678042A5023868486 @default.
• W2014678042 hasAuthorship W2014678042A5039926688 @default.
• W2014678042 hasConcept C114373084 @default.
• W2014678042 hasConcept C124101348 @default.
• W2014678042 hasConcept C151730666 @default.
• W2014678042 hasConcept C166957645 @default.
• W2014678042 hasConcept C185592680 @default.
• W2014678042 hasConcept C202751555 @default.
• W2014678042 hasConcept C21951064 @default.
• W2014678042 hasConcept C2778473407 @default.
• W2014678042 hasConcept C2779095896 @default.
• W2014678042 hasConcept C2779343474 @default.
• W2014678042 hasConcept C41008148 @default.
• W2014678042 hasConcept C55493867 @default.
• W2014678042 hasConcept C57992300 @default.
• W2014678042 hasConcept C60644358 @default.
• W2014678042 hasConcept C70721500 @default.
• W2014678042 hasConcept C74187038 @default.
• W2014678042 hasConcept C86803240 @default.
• W2014678042 hasConcept C95457728 @default.
• W2014678042 hasConcept C99726746 @default.
• W2014678042 hasConceptScore W2014678042C114373084 @default.
• W2014678042 hasConceptScore W2014678042C124101348 @default.
• W2014678042 hasConceptScore W2014678042C151730666 @default.
• W2014678042 hasConceptScore W2014678042C166957645 @default.
• W2014678042 hasConceptScore W2014678042C185592680 @default.
• W2014678042 hasConceptScore W2014678042C202751555 @default.
• W2014678042 hasConceptScore W2014678042C21951064 @default.
• W2014678042 hasConceptScore W2014678042C2778473407 @default.
• W2014678042 hasConceptScore W2014678042C2779095896 @default.
• W2014678042 hasConceptScore W2014678042C2779343474 @default.
• W2014678042 hasConceptScore W2014678042C41008148 @default.
• W2014678042 hasConceptScore W2014678042C55493867 @default.
• W2014678042 hasConceptScore W2014678042C57992300 @default.
• W2014678042 hasConceptScore W2014678042C60644358 @default.
• W2014678042 hasConceptScore W2014678042C70721500 @default.
• W2014678042 hasConceptScore W2014678042C74187038 @default.
• W2014678042 hasConceptScore W2014678042C86803240 @default.
• W2014678042 hasConceptScore W2014678042C95457728 @default.
• W2014678042 hasConceptScore W2014678042C99726746 @default.
• W2014678042 hasIssue "4" @default.
• W2014678042 hasLocation W20146780421 @default.
• W2014678042 hasLocation W20146780422 @default.
• W2014678042 hasOpenAccess W2014678042 @default.
• W2014678042 hasPrimaryLocation W20146780421 @default.
• W2014678042 hasRelatedWork W1964288351 @default.
• W2014678042 hasRelatedWork W1989116199 @default.
• W2014678042 hasRelatedWork W2041808719 @default.
• W2014678042 hasRelatedWork W2295441452 @default.
• W2014678042 hasRelatedWork W2597182293 @default.
• W2014678042 hasRelatedWork W2787593686 @default.
• W2014678042 hasRelatedWork W2896688061 @default.
• W2014678042 hasRelatedWork W2921492615 @default.
• W2014678042 hasRelatedWork W2923110034 @default.
• W2014678042 hasRelatedWork W4366750930 @default.
• W2014678042 hasVolume "3" @default.
• W2014678042 isParatext "false" @default.
• W2014678042 isRetracted "false" @default.

• next