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April 11th, 2025


Compound category: Organic compounds
(total 903 related compounds in database, current show from 731 to 740)
 
Compound name 2D structure Target pathogen(s) Related VF/VFcategory Max phase Reference(s)
Nicotinic acid (5-bromo-2-hydroxy-benzylidene)-hydrazide Depiction based on curated SMILES N OH O Br N N H Salmonella
Shigella
TTSS (SPI-1 encode); TTSS (SPI-2 encode)
TTSS (Type III secretion system)
Preclinical (in vitro)
Preclinical (in vitro)
Negrea A, et al. 2007. Antimicrob Agents Chemother
Veenendaal AK, et al. 2009. J Bacteriol
N-[2-[4-(benzimidazol-1-yl)anilino]-2-oxoethyl]-3-chloro-1-benzothiophene-2-carboxamide Depiction based on curated SMILES N H N N O S Cl O N H Salmonella
Yersinia
TTSS (SPI-1 encode)
TTSS (Type III secretion system)
Preclinical (in vitro)
Preclinical (in vivo)
Boonyom R, et al. 2022. J Genet Eng Biotechnol
Swietnicki W, et al. 2011. PLoS One
(E)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-[3-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]prop-2-enamide Depiction based on curated SMILES S S O O CH 3 S H 3 C N HN O O N Shigella TTSS (Type III secretion system) Preclinical (in vitro) Case HB, et al. 2018. Biochemistry
1'-butyl-4'-(nitromethyl)-1',4'-dihydro-2,3'-biquinoline Depiction based on curated SMILES _ O O + N H 3 C N N Shigella VirF Preclinical (in vitro) Koppolu V, et al. 2013. Infect Immun
4-Methoxy-beta-nitrostyrene Depiction based on curated SMILES CH 3 O + N O _ O Shigella VirF Preclinical (in vitro) Hurt JK, et al. 2010. J Biomol Screen
1-Phenyl-3-(1,2,3-thiadiazol-5-yl)urea Depiction based on curated SMILES O NH N H N N S Shigella VirF Preclinical (in vitro) Hurt JK, et al. 2010. J Biomol Screen; Emanuele AA, et al. 2014. J Antibiot (Tokyo); Emanuele AA, et al. 2015. PLoS One
4-Aminoquinaldine Depiction based on curated SMILES CH 3 NH 2 N Shigella TTSS (Type III secretion system) Preclinical (in vitro) Dey S, et al. 2017. ChemMedChem
3,5-di(3-pyridylmethyl)-1,3,5-thiadiazinane-2-thione Depiction based on curated SMILES N N S S N N Shigella VirF Preclinical (in vitro) Hurt JK, et al. 2010. J Biomol Screen
2-phenyl-2,3-dihydrophthalazine-1,4-dione Depiction based on curated SMILES O O N HN Shigella VirF Preclinical (in vitro) Hurt JK, et al. 2010. J Biomol Screen
4-(2-(Pyrrolidin-1-yl)ethyl)aniline Depiction based on curated SMILES H 2 N N Shigella TTSS (Type III secretion system) Preclinical (in vitro) Dey S, et al. 2017. ChemMedChem
   


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