Matches in SemOpenAlex for { <https://semopenalex.org/work/W2074002287> ?p ?o ?g. }
Showing items 1 to 79 of
79
with 100 items per page.
- W2074002287 endingPage "767" @default.
- W2074002287 startingPage "761" @default.
- W2074002287 abstract "A 3D-QSAR study using CoMFA methodology was conducted on a series of 29 symmetrical bis-benzamide cyclic urea derivatives having anti-HIV-1-protease activities. Active site minimization of the ligands was used to exclude conformations which are not sterically accessible within the active site. A significant cross-validated correlation coefficient q2 (0.724) was obtained indicating the predictive potential of the model for untested compounds of this class. A significant non-cross-validated correlation coefficient (r2) of 0.971 with a low standard error estimate (S) of 0.119 was obtained indicating that the model reliably predicted the anti-protease activities of poorly to highly active compounds. The model was used to predict the anti-protease activities of eight test-set compounds, and the predicted values were in good agreement with the experimental values. The CoMFA coefficient contour plots identified several key features which explain the wide range of activities. The already reported 2D-QSAR along with the CoMFA model presented here may help in designing effective HIV-1 protease inhibitors." @default.
- W2074002287 created "2016-06-24" @default.
- W2074002287 creator A5006925420 @default.
- W2074002287 date "1998-06-06" @default.
- W2074002287 modified "2023-09-24" @default.
- W2074002287 title "Comparative Molecular Field Analysis (CoMFA) of a Series of Symmetrical Bis-Benzamide Cyclic Urea Derivatives as HIV-1 Protease Inhibitors<sup>†</sup>" @default.
- W2074002287 cites W1966041739 @default.
- W2074002287 cites W1992293705 @default.
- W2074002287 cites W2019257250 @default.
- W2074002287 cites W2035341183 @default.
- W2074002287 cites W2052080593 @default.
- W2074002287 cites W2063060349 @default.
- W2074002287 cites W2080786231 @default.
- W2074002287 cites W2161239029 @default.
- W2074002287 cites W2950919680 @default.
- W2074002287 cites W2951073242 @default.
- W2074002287 cites W4294293047 @default.
- W2074002287 doi "https://doi.org/10.1021/ci980014c" @default.
- W2074002287 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/9691478" @default.
- W2074002287 hasPublicationYear "1998" @default.
- W2074002287 type Work @default.
- W2074002287 sameAs 2074002287 @default.
- W2074002287 citedByCount "28" @default.
- W2074002287 countsByYear W20740022872012 @default.
- W2074002287 countsByYear W20740022872013 @default.
- W2074002287 countsByYear W20740022872014 @default.
- W2074002287 countsByYear W20740022872017 @default.
- W2074002287 crossrefType "journal-article" @default.
- W2074002287 hasAuthorship W2074002287A5006925420 @default.
- W2074002287 hasConcept C105795698 @default.
- W2074002287 hasConcept C147597530 @default.
- W2074002287 hasConcept C164126121 @default.
- W2074002287 hasConcept C178790620 @default.
- W2074002287 hasConcept C181199279 @default.
- W2074002287 hasConcept C185592680 @default.
- W2074002287 hasConcept C201194858 @default.
- W2074002287 hasConcept C2776714187 @default.
- W2074002287 hasConcept C2777583353 @default.
- W2074002287 hasConcept C2780092901 @default.
- W2074002287 hasConcept C2780231548 @default.
- W2074002287 hasConcept C2780365088 @default.
- W2074002287 hasConcept C33923547 @default.
- W2074002287 hasConcept C71240020 @default.
- W2074002287 hasConceptScore W2074002287C105795698 @default.
- W2074002287 hasConceptScore W2074002287C147597530 @default.
- W2074002287 hasConceptScore W2074002287C164126121 @default.
- W2074002287 hasConceptScore W2074002287C178790620 @default.
- W2074002287 hasConceptScore W2074002287C181199279 @default.
- W2074002287 hasConceptScore W2074002287C185592680 @default.
- W2074002287 hasConceptScore W2074002287C201194858 @default.
- W2074002287 hasConceptScore W2074002287C2776714187 @default.
- W2074002287 hasConceptScore W2074002287C2777583353 @default.
- W2074002287 hasConceptScore W2074002287C2780092901 @default.
- W2074002287 hasConceptScore W2074002287C2780231548 @default.
- W2074002287 hasConceptScore W2074002287C2780365088 @default.
- W2074002287 hasConceptScore W2074002287C33923547 @default.
- W2074002287 hasConceptScore W2074002287C71240020 @default.
- W2074002287 hasIssue "4" @default.
- W2074002287 hasLocation W20740022871 @default.
- W2074002287 hasLocation W20740022872 @default.
- W2074002287 hasOpenAccess W2074002287 @default.
- W2074002287 hasPrimaryLocation W20740022871 @default.
- W2074002287 hasRelatedWork W1488660201 @default.
- W2074002287 hasRelatedWork W2006915657 @default.
- W2074002287 hasRelatedWork W2030067016 @default.
- W2074002287 hasRelatedWork W2039209783 @default.
- W2074002287 hasRelatedWork W2074002287 @default.
- W2074002287 hasRelatedWork W2091806755 @default.
- W2074002287 hasRelatedWork W2278947537 @default.
- W2074002287 hasRelatedWork W2528301918 @default.
- W2074002287 hasRelatedWork W2951166099 @default.
- W2074002287 hasRelatedWork W2953125207 @default.
- W2074002287 hasVolume "38" @default.
- W2074002287 isParatext "false" @default.
- W2074002287 isRetracted "false" @default.
- W2074002287 magId "2074002287" @default.
- W2074002287 workType "article" @default.