TDR Targets

Basic information

Technical information

TDR Targets ID: 798803
Name: 1-[4-[3-(cyclopropylamino)-4-nitrophenyl]pipe razin-1-yl]-2-methylpropan-1-one
MW: 332.397 | Formula: C17H24N4O3
H donors: 1 H acceptors: 3 LogP: 3.28 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: O=C(N1CCN(CC1)c1ccc(c(c1)NC1CC1)[N+](=O)[O-])C(C)C
InChi: 1S/C17H24N4O3/c1-12(2)17(22)20-9-7-19(8-10-20)14-5-6-16(21(23)24)15(11-14)18-13-3-4-13/h5-6,11-13,18H,3-4,7-10H2,1-2H3
InChiKey: PXGQGLQGYKIEBC-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

1-[4-[3-(cyclopropylamino)-4-nitro-phenyl]piperazin-1-yl]-2-methyl-propan-1-one
1-[4-[3-(cyclopropylamino)-4-nitrophenyl]-1-piperazinyl]-2-methylpropan-1-one
Oprea1_037930
A3146/0132998
ZINC04188703

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.00538805	0.370546	0.370545
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	oxidoreductase	0.00029976	0.019471	0.5
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.014511	1	1
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Onchocerca volvulus		0.00029976	0.019471	0.5
Brugia malayi	hypothetical protein	0.00272392	0.18673	0.186729
Echinococcus multilocularis	carbonic anhydrase	0.00538805	0.370546	0.370546
Schistosoma mansoni	carbonyl reductase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable short-chain dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Brugia malayi	dehydrogenases, short chain protein 2	0.00029976	0.019471	0.0194694
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	ketoacyl reductase	0.00029976	0.019471	0.5
Echinococcus multilocularis	steroid dehydrogenase	0.00029976	0.019471	0.019471
Echinococcus multilocularis	retinol dehydrogenase 11	0.00029976	0.019471	0.019471
Echinococcus multilocularis	retinol dehydrogenase 11	0.00029976	0.019471	0.019471
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Echinococcus multilocularis	transient receptor potential cation channel	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable oxidoreductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	3-ketoacyl-ACP reductase	0.00029976	0.019471	0.5
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 1 homolog	0.00029976	0.019471	0.5
Onchocerca volvulus		0.00029976	0.019471	0.5
Echinococcus granulosus	hypothetical protein	0.00029976	0.019471	0.019471
Echinococcus granulosus	carbonyl reductase 1	0.00029976	0.019471	0.019471
Onchocerca volvulus		0.00029976	0.019471	0.5
Echinococcus multilocularis	kelch protein 3	0.0000175826	0.0000016269	0.0000016269
Mycobacterium leprae	Probable oxidoreductase	0.00029976	0.019471	0.5
Echinococcus multilocularis	kelch protein 18	0.0000175826	0.0000016269	0.0000016269
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.00272392	0.18673	0.18673
Onchocerca volvulus		0.00029976	0.019471	0.5
Mycobacterium ulcerans	dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium tuberculosis	Possible iron-regulated short-chain dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Trichomonas vaginalis	short-chain dehydrogenases/reductase, putative	0.00029976	0.019471	0.5
Brugia malayi	dehydrogenases, short chain protein 9	0.00029976	0.019471	0.0194694
Loa Loa (eye worm)	dehydrogenase	0.00029976	0.019471	0.0194694
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 13 homolog	0.00029976	0.019471	0.5
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	dehydrogenase	0.00029976	0.019471	0.5
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Echinococcus granulosus	ectoderm neural cortex protein 1	0.0000175826	0.0000016269	0.0000016269
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.00029976	0.019471	0.019471
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Possible oxidoreductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short-chain dehydrogenase	0.00029976	0.019471	0.5
Schistosoma mansoni	hypothetical protein	0.0000175826	0.0000016269	0.0000016269
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable dehydrogenase/reductase	0.00029976	0.019471	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Possible short-chain dehydrogenase EphD	0.00029976	0.019471	0.5
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.00538805	0.370546	0.370545
Mycobacterium leprae	Possible short-chain dehydrogenase EphD	0.00029976	0.019471	0.5
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Echinococcus granulosus	kelch ECH associated protein 1 like	0.00755603	0.52013	0.52013
Echinococcus granulosus	steroid dehydrogenase	0.00029976	0.019471	0.019471
Echinococcus granulosus	carbonic anhydrase II	0.014511	1	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.00029976	0.019471	0.5
Entamoeba histolytica	hypothetical protein	0.00272392	0.18673	1
Echinococcus multilocularis	carbonyl reductase 1	0.00029976	0.019471	0.019471
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Echinococcus multilocularis	carbonic anhydrase	0.00538805	0.370546	0.370546
Mycobacterium ulcerans	ketoacyl reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Echinococcus granulosus	kelch protein 3	0.0000175826	0.0000016269	0.0000016269
Echinococcus multilocularis	epidermal retinal dehydrogenase 2	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.00538805	0.370546	0.370545
Echinococcus granulosus	WW domain containing oxidoreductase	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	short-chain dehydrogenase	0.00029976	0.019471	0.5
Echinococcus multilocularis	carbonyl reductase 1	0.00029976	0.019471	0.019471
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.014511	1	1
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.00538805	0.370546	0.370545
Brugia malayi	hypothetical protein	0.00029976	0.019471	0.0194694
Echinococcus multilocularis	3 ketodihydrosphingosine reductase	0.00029976	0.019471	0.019471
Schistosoma mansoni	hypothetical protein	0.00757204	0.521234	0.521234
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Plasmodium vivax	steroid dehydrogenase, putative	0.00029976	0.019471	0.5
Schistosoma mansoni	retinal dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Giardia lamblia	Reductase, putative	0.00029976	0.019471	0.5
Onchocerca volvulus		0.00029976	0.019471	0.5
Echinococcus multilocularis	carbonic anhydrase II	0.014511	1	1
Brugia malayi	Retinol dehydrogenase 12	0.00029976	0.019471	0.0194694
Mycobacterium leprae	ROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCTASE	0.00029976	0.019471	0.5
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Echinococcus granulosus	kelch protein 12	0.0000175826	0.0000016269	0.0000016269
Echinococcus multilocularis	Kelch repeat type 1	0.00757204	0.521234	0.521234
Onchocerca volvulus		0.00029976	0.019471	0.5
Loa Loa (eye worm)	hypothetical protein	0.00538805	0.370546	0.370545
Echinococcus granulosus	carbonic anhydrase	0.00538805	0.370546	0.370546
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Echinococcus granulosus	kelch protein 18	0.0000175826	0.0000016269	0.0000016269
Brugia malayi	D-beta-hydroxybutyrate dehydrogenase, mitochondrial precursor	0.00029976	0.019471	0.0194694
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Possible ketoacyl reductase	0.00029976	0.019471	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Schistosoma mansoni	hypothetical protein	0.0000175826	0.0000016269	0.0000016269
Plasmodium vivax	hypothetical protein, conserved	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short-chain membrane-associated dehydrogenase	0.00029976	0.019471	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Echinococcus multilocularis	carbonyl reductase 1	0.00029976	0.019471	0.019471
Brugia malayi	oxidoreductase	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	short-chain type oxidoreductase	0.00029976	0.019471	0.5
Brugia malayi	hypothetical protein	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Probable oxidoreductase	0.00029976	0.019471	0.5
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Schistosoma mansoni	carbonic anhydrase-related	0.00538805	0.370546	0.370546
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Echinococcus multilocularis	retinol dehydrogenase 13	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Schistosoma mansoni	transcription factor LCR-F1	0.00272392	0.18673	0.18673
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Trichomonas vaginalis	steroid dehydrogenase, putative	0.00029976	0.019471	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Mycobacterium tuberculosis	Possible fatty acyl-CoA reductase	0.00029976	0.019471	0.5
Schistosoma mansoni	hypothetical protein	0.00272392	0.18673	0.18673
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Schistosoma mansoni	short-chain dehydrogenase/reductase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Possible multi-functional enzyme with acyl-CoA-reductase activity AcrA1	0.00029976	0.019471	0.5
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Mycobacterium leprae	PROBABLE SHORT CHAIN ALCOHOL DEHYDROGENASE/REDUCTASE	0.00029976	0.019471	0.5
Mycobacterium tuberculosis	Probable short chain alcohol dehydrogenase/reductase	0.00029976	0.019471	0.5
Entamoeba histolytica	hypothetical protein	0.00272392	0.18673	1
Mycobacterium ulcerans	short-chain dehydrogenase	0.00029976	0.019471	0.5
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.00538805	0.370546	0.370545
Echinococcus multilocularis	carbonic anhydrase	0.00538805	0.370546	0.370546
Mycobacterium ulcerans	carveol-like dehydrogenase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	3-alpha-hydroxysteroid dehydrogenase	0.00029976	0.019471	0.5
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Entamoeba histolytica	hypothetical protein	0.00272392	0.18673	1
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Echinococcus granulosus	kelch ECH associated protein 1	0.00755603	0.52013	0.52013
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Onchocerca volvulus		0.00029976	0.019471	0.5
Onchocerca volvulus		0.00029976	0.019471	0.5
Mycobacterium ulcerans	short-chain dehydrogenase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Echinococcus multilocularis	carbonyl reductase 1	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable shortchain dehydrogenase	0.00029976	0.019471	0.5
Echinococcus granulosus	Dehydrogenase:reductase SDR family	0.00029976	0.019471	0.019471
Echinococcus granulosus	epidermal retinal dehydrogenase 2	0.00029976	0.019471	0.019471
Loa Loa (eye worm)	carbonic anhydrase 3	0.014511	1	1
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Giardia lamblia	Hypothetical protein	0.00029976	0.019471	0.5
Echinococcus granulosus	carbonic anhydrase	0.00538805	0.370546	0.370546
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Trichomonas vaginalis	hydroxyacyl dehydrogenase, putative	0.00029976	0.019471	0.5
Wolbachia endosymbiont of Brugia malayi	Short-chain alcohol dehydrogenase family enzyme	0.00029976	0.019471	0.5
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Onchocerca volvulus		0.00029976	0.019471	0.5
Schistosoma mansoni	carbonic anhydrase	0.00538805	0.370546	0.370546
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Decaprenylphosphoryl-D-2-keto erythro pentose reductase	0.00029976	0.019471	0.5
Entamoeba histolytica	hypothetical protein	0.00272392	0.18673	1
Trypanosoma brucei	carbonic anhydrase-like protein	0.014511	1	1
Loa Loa (eye worm)	hypothetical protein	0.00538805	0.370546	0.370545
Loa Loa (eye worm)	hypothetical protein	0.00538805	0.370546	0.370545
Schistosoma mansoni	carbonic anhydrase-related	0.00538805	0.370546	0.370546
Mycobacterium ulcerans	ketoacyl reductase	0.00029976	0.019471	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Leishmania major	carbonic anhydrase-like protein	0.014511	1	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.00272392	0.18673	0.18673
Echinococcus granulosus	carbonic anhydrase	0.00538805	0.370546	0.370546
Echinococcus multilocularis	kelch ECH associated protein 1	0.00755603	0.52013	0.52013
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 13 homolog	0.00029976	0.019471	0.5
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Brugia malayi	Putative carbonic anhydrase 5 precursor	0.014511	1	1
Echinococcus granulosus	retinol dehydrogenase 11	0.00029976	0.019471	0.019471
Onchocerca volvulus		0.00029976	0.019471	0.5
Schistosoma mansoni	hypothetical protein	0.0000175826	0.0000016269	0.0000016269
Echinococcus multilocularis	conserved hypothetical protein	0.00029976	0.019471	0.019471
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	dehydrogenase/decarboxylase protein	0.00029976	0.019471	0.5
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.014511	1	1
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.014511	1	1
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.014511	1	1
Echinococcus multilocularis	ectoderm neural cortex protein 1	0.0000175826	0.0000016269	0.0000016269
Schistosoma mansoni	hypothetical protein	0.0000175826	0.0000016269	0.0000016269
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Brugia malayi	Dehydrogenases, short chain protein 2	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Echinococcus multilocularis	estradiol 17 beta dehydrogenase 12	0.00029976	0.019471	0.019471
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Schistosoma mansoni	oxidoreductase short chain dehydrogenase/reductase family	0.00029976	0.019471	0.019471
Schistosoma mansoni	steroid dehydrogenase	0.00029976	0.019471	0.019471
Giardia lamblia	Short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Mycobacterium leprae	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.00029976	0.019471	0.0194694
Echinococcus granulosus	oxidoreductase	0.00029976	0.019471	0.019471
Echinococcus granulosus	carbonyl reductase 1	0.00029976	0.019471	0.019471
Trichomonas vaginalis	estradiol 17 beta-dehydrogenase, putative	0.00029976	0.019471	0.5
Echinococcus granulosus	retinol dehydrogenase 11	0.00029976	0.019471	0.019471
Schistosoma mansoni	carbonic anhydrase-related	0.00538805	0.370546	0.370546
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Giardia lamblia	Oxidoreductase, short chain dehydrogenase/reductase family	0.00029976	0.019471	0.5
Mycobacterium ulcerans	oxidoreductase	0.00029976	0.019471	0.5
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Toxoplasma gondii	hypothetical protein	0.00538805	0.370546	1
Onchocerca volvulus		0.00029976	0.019471	0.5
Loa Loa (eye worm)	short chain dehydrogenase/reductase family oxidoreductase	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Probable oxidoreductase	0.00029976	0.019471	0.5
Loa Loa (eye worm)	dehydrogenase	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.00029976	0.019471	0.019471
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Brugia malayi	Dehydrogenases, short chain protein 30	0.00029976	0.019471	0.0194694
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Echinococcus granulosus	3 ketodihydrosphingosine reductase	0.00029976	0.019471	0.019471
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Onchocerca volvulus	Sepiapterin reductase homolog	0.00029976	0.019471	0.5
Echinococcus granulosus	hypothetical protein	0.00029976	0.019471	0.019471
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Loa Loa (eye worm)	oxidoreductase	0.00029976	0.019471	0.0194694
Echinococcus multilocularis	steroid dehydrogenase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable short-chain type oxidoreductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Schistosoma mansoni	carbonyl reductase	0.00029976	0.019471	0.019471
Echinococcus granulosus	carbonyl reductase 1	0.00029976	0.019471	0.019471
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Brugia malayi	Hypothetical oxidoreductase F56D1.5	0.00029976	0.019471	0.0194694
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.00029976	0.019471	0.5
Echinococcus multilocularis	oxidoreductase	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Schistosoma mansoni	hypothetical protein	0.00538805	0.370546	0.370546
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Mycobacterium leprae	Probable short-chain type dehydrogenase/reductase	0.00029976	0.019471	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Echinococcus multilocularis	kelch ECH associated protein 1	0.00755603	0.52013	0.52013
Schistosoma mansoni	3-keto-dihydrosphingosine reductase	0.00029976	0.019471	0.019471
Mycobacterium tuberculosis	Probable oxidoreductase	0.00029976	0.019471	0.5
Echinococcus granulosus	carbonyl reductase 1	0.00029976	0.019471	0.019471
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Mycobacterium ulcerans	short chain dehydrogenase	0.00029976	0.019471	0.5
Schistosoma mansoni	carbonyl reductase	0.00029976	0.019471	0.019471
Echinococcus multilocularis	Dehydrogenase:reductase SDR family	0.00029976	0.019471	0.019471
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.00029976	0.019471	0.019471
Plasmodium falciparum	carbonic anhydrase	0.00538805	0.370546	1
Onchocerca volvulus		0.00029976	0.019471	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Probable oxidoreductase	0.00029976	0.019471	0.5
Mycobacterium tuberculosis	Probable dehydrogenase/reductase	0.00029976	0.019471	0.5
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.014511	1	1
Echinococcus granulosus	kelch ECH associated protein 1 like	0.00755603	0.52013	0.52013
Mycobacterium tuberculosis	Possible oxidoreductase	0.00029976	0.019471	0.5
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Mycobacterium tuberculosis	Probable dehydrogenase	0.00029976	0.019471	0.5
Loa Loa (eye worm)	hypothetical protein	0.00029976	0.019471	0.0194694
Onchocerca volvulus		0.00029976	0.019471	0.5
Echinococcus multilocularis	kelch protein 12	0.0000175826	0.0000016269	0.0000016269
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.00538805	0.370546	0.370545
Schistosoma mansoni	short chain dehydrogenase	0.00029976	0.019471	0.019471

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	4.455 uM	ST_JUDE: Plasmodium falciparum 3D7 EC50 (uM) as measured by SYBR green dye	ChEMBL.	20485428
EC50 (functional)	= 4.46 uM	Plasmodium falciparum 3D7 EC50 (uM) as measured by SYBR green dye	Saint Jude.	20485428
EC50 (functional)	6.7672 uM	ST_JUDE: Plasmodium falciparum K1 EC50 (uM) as measured by SYBR green dye	ChEMBL.	20485428
EC50 (functional)	= 6.77 uM	Plasmodium falciparum K1 EC50 (uM) as measured by SYBR green dye	Saint Jude.	20485428
Percent growth inhibition (functional)	= 86 %	Plasmodium falciparum 3D7 % growth inhibition at 7uM as measured by YOYO-3 red dye	Saint Jude.	20485428
Percent growth inhibition (functional)	= 92.4 %	Plasmodium falciparum 3D7 % growth inhibition at 7uM as measured by SYBR green dye	Saint Jude.	20485428

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23	20485428

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL592583
Search by Saint Jude

Bibliographic References

No literature references available for this target.

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Detailed information for compound 798803