Literature summary for 2.3.1.97 extracted from

Garcia, M.; de Oliveira, A.; Bueno, R.; Nogueira, V.; de Souza, G.; Guido, R.
QSAR studies on benzothiophene derivatives as Plasmodium falciparum N-myristoyltransferase inhibitors Molecular insights into affinity and selectivity (2020), Drug Dev. Res., 2020, 1-21 .

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Inhibitors

Inhibitors	Comment	Organism	Structure
4-[(2-[5-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1,3,4-oxadiazol-2-yl]-1-benzothiophen-3-yl)oxy]piperidine	selective and high affinity Plasmodium falciparum inhibitor, pKi value for human enzyme 7.22	Homo sapiens
4-[(2-[5-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1,3,4-oxadiazol-2-yl]-1-benzothiophen-3-yl)oxy]piperidine	selective and high affinity inhibitor, pKi value 8.10	Plasmodium falciparum
additional information	2D and 3D quantitative structure-activity relationship (QSAR) studies on a series of benzothiophene derivatives as Plasmodium falciparum NMT and human NMT inhibitors. The polar interactions (electrostatic and hydrogen-bonding properties) as the major molecular features that affected the inhibitory activity and selectivity	Homo sapiens
additional information	2D and 3D quantitative structure-activity relationship (QSAR) studies on a series of benzothiophene derivatives as Plasmodium falciparum NMT and human NMT inhibitors. The polar interactions (electrostatic and hydrogen-bonding properties) as the major molecular features that affected the inhibitory activity and selectivity	Plasmodium falciparum

Organism

Organism	UniProt	Comment	Textmining
Homo sapiens	-	-	-
Plasmodium falciparum	-	-	-

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Release 2023.1 (January 2023)