Literature summary for 2.1.2.2 extracted from

Chong, Y.; Hwang, I.; Tavassoli, A.; Zhang, Y.; Wilson, I.A.; Benkovic, S.J.; Boger, D.L.
Synthesis and biological evaluation of alpha- and gamma-carboxamide derivatives of 10-CF3CO-DDACTHF (2005), Bioorg. Med. Chem., 13, 3587-3592.

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Inhibitors

Inhibitors	Comment	Organism	Structure
10-trifluoroacetyl-DDACTHF	-	Escherichia coli
10-trifluoroacetyl-DDACTHF	-	Homo sapiens
4-carbamoyl-2-[4-[4-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-1-(2,2,2-trifluoroacetyl)butyl]benzoylamino]butyric acid	-	Escherichia coli
4-carbamoyl-2-[4-[4-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-1-(2,2,2-trifluoroacetyl)butyl]benzoylamino]butyric acid	-	Homo sapiens
4-carbamoyl-4-[4-[4-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-1-(2,2,2-trifluoroacetyl)butyl]benzoylamino]butyric acid	-	Escherichia coli
4-carbamoyl-4-[4-[4-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-1-(2,2,2-trifluoroacetyl)butyl]benzoylamino]butyric acid	-	Homo sapiens
DDACTHF	-	Escherichia coli
DDACTHF	-	Homo sapiens

Organism

Organism	UniProt	Comment	Textmining
Escherichia coli	-	-	-
Homo sapiens	-	recombinant	-

Ki Value [mM]

Ki Value [mM]	Ki Value maximum [mM]	Inhibitor	Comment	Organism	Structure
additional information	-	additional information	4-carbamoyl-2-[4-[4-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-1-(2,2,2-trifluoroacetyl)butyl]benzoylamino]butyric acid and 4-carbamoyl-4-[4-[4-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-1-(2,2,2-trifluoroacetyl)butyl]benzoylamino]butyric acid show Ki-values above 0.1 mM	Escherichia coli
0.000015	-	10-trifluoroacetyl-DDACTHF	26°C, pH 7.5	Homo sapiens
0.000056	-	4-carbamoyl-2-[4-[4-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-1-(2,2,2-trifluoroacetyl)butyl]benzoylamino]butyric acid	26°C, pH 7.5	Homo sapiens
0.0017	-	DDACTHF	26°C, pH 7.5	Homo sapiens
0.0019	-	10-trifluoroacetyl-DDACTHF	26°C, pH 7.5	Escherichia coli
0.0048	-	4-carbamoyl-4-[4-[4-(2,4-diamino-6-oxo-1,6-dihydropyrimidin-5-yl)-1-(2,2,2-trifluoroacetyl)butyl]benzoylamino]butyric acid	26°C, pH 7.5	Homo sapiens
0.005	-	DDACTHF	26°C, pH 7.5	Escherichia coli

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Release 2023.1 (January 2023)