TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 370.402 | Formula: C17H10N2O4S2
H donors: 2 H acceptors: 3 LogP: 2.36 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: S=C1NC(=O)C(=Cc2ccc(s2)c2ccc3c(c2)COC3=O)C(=O)N1
InChi: 1S/C17H10N2O4S2/c20-14-12(15(21)19-17(24)18-14)6-10-2-4-13(25-10)8-1-3-11-9(5-8)7-23-16(11)22/h1-6H,7H2,(H2,18,19,20,21,24)
InChiKey: PMHNLEVTQIKNGD-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	perforin 1 (pore forming protein)	Starlite/ChEMBL	References

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
Loa Loa (eye worm)	short chain dehydrogenase/reductase family oxidoreductase	0.0026	0.5	0.5
Trypanosoma cruzi	oxidoreductase-like protein, putative	0.0026	0.5	0.5
Leishmania major	short chain dehydrogenase, putative	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Entamoeba histolytica	hypothetical protein, conserved	0.0026	0.5	0.5
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 13 homolog	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable shortchain dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	dehydrogenase/decarboxylase protein	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Echinococcus multilocularis	steroid dehydrogenase	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Plasmodium vivax	steroid dehydrogenase, putative	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Echinococcus granulosus	Dehydrogenase:reductase SDR family	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Trypanosoma cruzi	short chain dehydrogenase/reductase, putative	0.0026	0.5	0.5
Mycobacterium tuberculosis	Possible ketoacyl reductase	0.0026	0.5	0.5
Trypanosoma cruzi	beta-ketoacyl-ACP reductase 2, putative	0.0026	0.5	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Trypanosoma cruzi	beta-ketoacyl-ACP reductase 2, putative	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.0026	0.5	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Trypanosoma cruzi	3-ketoacyl-CoA reductase, putative	0.0026	0.5	0.5
Mycobacterium leprae	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Loa Loa (eye worm)	dehydrogenase	0.0026	0.5	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.0026	0.5	0.5
Toxoplasma gondii	oxidoreductase, putative	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.0026	0.5	0.5
Plasmodium falciparum	steroid dehydrogenase, putative	0.0026	0.5	0.5
Mycobacterium tuberculosis	Possible oxidoreductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Possible fatty acyl-CoA reductase	0.0026	0.5	0.5
Leishmania major	3-keto-dihydrosphingosine reductase	0.0026	0.5	0.5
Echinococcus granulosus	steroid dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0026	0.5	0.5
Trypanosoma brucei	beta-D-hydroxybutyrate dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Leishmania major	hypothetical protein, conserved	0.0026	0.5	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.5	0.5
Entamoeba histolytica	oxidoreductase, short chain dehydrogenase/reductase family	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain membrane-associated dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Entamoeba histolytica	estradiol 17-beta-dehydrogenase, putative	0.0026	0.5	0.5
Toxoplasma gondii	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short chain alcohol dehydrogenase/reductase	0.0026	0.5	0.5
Leishmania major	short chain dehydrogenase-like protein	0.0026	0.5	0.5
Schistosoma mansoni	oxidoreductase short chain dehydrogenase/reductase family	0.0026	0.5	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.0026	0.5	0.5
Echinococcus granulosus	carbonyl reductase 1	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Echinococcus granulosus	WW domain containing oxidoreductase	0.0026	0.5	0.5
Entamoeba histolytica	estradiol 17-beta-dehydrogenase, putative	0.0026	0.5	0.5
Toxoplasma gondii	2,4-dienoyl CoA reductase 2, peroxisomal family protein	0.0026	0.5	0.5
Leishmania major	hypothetical protein, conserved	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Brugia malayi	D-beta-hydroxybutyrate dehydrogenase, mitochondrial precursor	0.0026	0.5	0.5
Mycobacterium ulcerans	carveol-like dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0026	0.5	0.5
Entamoeba histolytica	hypothetical protein, conserved	0.0026	0.5	0.5
Giardia lamblia	Oxidoreductase, short chain dehydrogenase/reductase family	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain dehydrogenase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Trypanosoma brucei	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Echinococcus granulosus	hypothetical protein	0.0026	0.5	0.5
Wolbachia endosymbiont of Brugia malayi	Short-chain alcohol dehydrogenase family enzyme	0.0026	0.5	0.5
Trypanosoma cruzi	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Brugia malayi	hypothetical protein	0.0026	0.5	0.5
Entamoeba histolytica	3-ketodihydrosphingosine reductase protein, putative	0.0026	0.5	0.5
Trypanosoma brucei	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 13 homolog	0.0026	0.5	0.5
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	oxidoreductase	0.0026	0.5	0.5
Toxoplasma gondii	carbonyl reductase 1, putative	0.0026	0.5	0.5
Brugia malayi	Hypothetical oxidoreductase F56D1.5	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	carbonyl reductase	0.0026	0.5	0.5
Trypanosoma brucei	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Brugia malayi	Retinol dehydrogenase 12	0.0026	0.5	0.5
Trypanosoma brucei	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Echinococcus granulosus	hypothetical protein	0.0026	0.5	0.5
Giardia lamblia	Short-chain dehydrogenase, putative	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Brugia malayi	hypothetical protein	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	ketoacyl reductase	0.0026	0.5	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Mycobacterium ulcerans	ketoacyl reductase	0.0026	0.5	0.5
Leishmania major	pteridine reductase 1	0.0026	0.5	0.5
Mycobacterium tuberculosis	Possible short-chain dehydrogenase EphD	0.0026	0.5	0.5
Trypanosoma cruzi	3-keto-dihydrosphingosine reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Trypanosoma cruzi	short chain dehydrogenase, putative	0.0026	0.5	0.5
Leishmania major	oxidoreductase-like protein	0.0026	0.5	0.5
Leishmania major	short chain dehydrogenase/reductase, putative	0.0026	0.5	0.5
Echinococcus granulosus	carbonyl reductase 1	0.0026	0.5	0.5
Plasmodium falciparum	oxidoreductase, short-chain dehydrogenase family, putative	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Echinococcus multilocularis	carbonyl reductase 1	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain dehydrogenase	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Echinococcus granulosus	epidermal retinal dehydrogenase 2	0.0026	0.5	0.5
Echinococcus multilocularis	epidermal retinal dehydrogenase 2	0.0026	0.5	0.5
Leishmania major	short chain dehydrogenase, putative	0.0026	0.5	0.5
Entamoeba histolytica	short chain dehydrogenase family protein	0.0026	0.5	0.5
Toxoplasma gondii	3-ketoacyl-CoA reductase, putative	0.0026	0.5	0.5
Echinococcus multilocularis	estradiol 17 beta dehydrogenase 12	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Trypanosoma cruzi	short chain dehydrogenase/reductase, putative	0.0026	0.5	0.5
Echinococcus multilocularis	retinol dehydrogenase 13	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Toxoplasma gondii	sterol carrier protein-2 HAD-2SCP-2	0.0026	0.5	0.5
Leishmania major	hypothetical protein, conserved	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable dehydrogenase/reductase	0.0026	0.5	0.5
Brugia malayi	Dehydrogenases, short chain protein 30	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain dehydrogenase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable dehydrogenase	0.0026	0.5	0.5
Echinococcus multilocularis	oxidoreductase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Echinococcus multilocularis	carbonyl reductase 1	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain type oxidoreductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type oxidoreductase	0.0026	0.5	0.5
Mycobacterium leprae	Probable oxidoreductase	0.0026	0.5	0.5
Entamoeba histolytica	hypothetical protein	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Brugia malayi	dehydrogenases, short chain protein 9	0.0026	0.5	0.5
Trypanosoma cruzi	NAD(P)-dependent oxidoreductase, putative	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Entamoeba histolytica	estradiol 17-beta-dehydrogenase, putative	0.0026	0.5	0.5
Echinococcus granulosus	retinol dehydrogenase 11	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable oxidoreductase	0.0026	0.5	0.5
Echinococcus multilocularis	transient receptor potential cation channel	0.0026	0.5	0.5
Trypanosoma cruzi	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Mycobacterium leprae	PROBABLE SHORT CHAIN ALCOHOL DEHYDROGENASE/REDUCTASE	0.0026	0.5	0.5
Trypanosoma brucei	3-ketoacyl-CoA reductase, putative	0.0026	0.5	0.5
Echinococcus multilocularis	conserved hypothetical protein	0.0026	0.5	0.5
Echinococcus multilocularis	carbonyl reductase 1	0.0026	0.5	0.5
Onchocerca volvulus	Dehydrogenase\/reductase SDR family member 1 homolog	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Schistosoma mansoni	retinal dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Giardia lamblia	Hypothetical protein	0.0026	0.5	0.5
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Possible oxidoreductase	0.0026	0.5	0.5
Trichomonas vaginalis	estradiol 17 beta-dehydrogenase, putative	0.0026	0.5	0.5
Trypanosoma brucei	3-keto-dihydrosphingosine reductase	0.0026	0.5	0.5
Echinococcus granulosus	carbonyl reductase 1	0.0026	0.5	0.5
Trypanosoma cruzi	3-keto-dihydrosphingosine reductase	0.0026	0.5	0.5
Trypanosoma brucei	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Echinococcus multilocularis	3 ketodihydrosphingosine reductase	0.0026	0.5	0.5
Mycobacterium leprae	ROBABLE SHORT-CHAIN TYPE DEHYDROGENASE/REDUCTASE	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Onchocerca volvulus	Sepiapterin reductase homolog	0.0026	0.5	0.5
Trichomonas vaginalis	hydroxyacyl dehydrogenase, putative	0.0026	0.5	0.5
Schistosoma mansoni	carbonyl reductase	0.0026	0.5	0.5
Brugia malayi	oxidoreductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Giardia lamblia	Reductase, putative	0.0026	0.5	0.5
Mycobacterium ulcerans	3-ketoacyl-ACP reductase	0.0026	0.5	0.5
Trypanosoma cruzi	3-ketoacyl-CoA reductase, putative	0.0026	0.5	0.5
Toxoplasma gondii	oxidoreductase, putative	0.0026	0.5	0.5
Echinococcus multilocularis	retinol dehydrogenase 11	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenases/reductase, putative	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Trypanosoma cruzi	NAD(P)-dependent oxidoreductase, putative	0.0026	0.5	0.5
Mycobacterium ulcerans	dehydrogenase/reductase	0.0026	0.5	0.5
Brugia malayi	dehydrogenases, short chain protein 2	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Loa Loa (eye worm)	dehydrogenase	0.0026	0.5	0.5
Trypanosoma brucei	beta-ketoacyl-ACP reductase 3, putative	0.0026	0.5	0.5
Plasmodium vivax	hypothetical protein, conserved	0.0026	0.5	0.5
Trypanosoma cruzi	short chain dehydrogenase, putative	0.0026	0.5	0.5
Echinococcus multilocularis	retinol dehydrogenase 11	0.0026	0.5	0.5
Trypanosoma brucei	oxidoreductase-like protein	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Leishmania major	quinonoid dihydropteridine reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Toxoplasma gondii	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Echinococcus granulosus	retinol dehydrogenase 11	0.0026	0.5	0.5
Mycobacterium tuberculosis	Possible multi-functional enzyme with acyl-CoA-reductase activity AcrA1	0.0026	0.5	0.5
Mycobacterium leprae	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Toxoplasma gondii	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Echinococcus granulosus	oxidoreductase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Leishmania major	hypothetical protein, conserved	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Entamoeba histolytica	short chain dehydrogenase family protein	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Possible iron-regulated short-chain dehydrogenase/reductase	0.0026	0.5	0.5
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0026	0.5	0.5
Mycobacterium ulcerans	ketoacyl reductase	0.0026	0.5	0.5
Schistosoma mansoni	carbonyl reductase	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	3-keto-dihydrosphingosine reductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Brugia malayi	Dehydrogenases, short chain protein 2	0.0026	0.5	0.5
Toxoplasma gondii	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0026	0.5	0.5
Echinococcus multilocularis	Dehydrogenase:reductase SDR family	0.0026	0.5	0.5
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0026	0.5	0.5
Mycobacterium tuberculosis	Decaprenylphosphoryl-D-2-keto erythro pentose reductase	0.0026	0.5	0.5
Trypanosoma cruzi	quinonoid dihydropteridine reductase, putative	0.0026	0.5	0.5
Leishmania major	short chain dehydrogenase/reductase, putative	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0026	0.5	0.5
Leishmania major	hypothetical protein, conserved	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Echinococcus multilocularis	steroid dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	oxidoreductase	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	3-alpha-hydroxysteroid dehydrogenase	0.0026	0.5	0.5
Trypanosoma cruzi	oxidoreductase-like protein, putative	0.0026	0.5	0.5
Echinococcus granulosus	carbonyl reductase 1	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Echinococcus multilocularis	carbonyl reductase 1	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Echinococcus granulosus	3 ketodihydrosphingosine reductase	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Trypanosoma brucei	beta-ketoacyl-ACP reductase 2	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Onchocerca volvulus		0.0026	0.5	0.5
Schistosoma mansoni	steroid dehydrogenase	0.0026	0.5	0.5
Mycobacterium ulcerans	short chain dehydrogenase	0.0026	0.5	0.5
Mycobacterium leprae	Possible short-chain dehydrogenase EphD	0.0026	0.5	0.5
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Leishmania major	dehydrogenase-like protein	0.0026	0.5	0.5
Trichomonas vaginalis	short-chain dehydrogenase, putative	0.0026	0.5	0.5
Schistosoma mansoni	short chain dehydrogenase	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Trichomonas vaginalis	steroid dehydrogenase, putative	0.0026	0.5	0.5
Loa Loa (eye worm)	oxidoreductase	0.0026	0.5	0.5
Toxoplasma gondii	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0026	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0026	0.5	0.5
Schistosoma mansoni	short-chain dehydrogenase/reductase	0.0026	0.5	0.5
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0026	0.5	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.4 uM	Inhibition of recombinant perforin-mediated lysis of Jurkat cells assessed as [51Cr] release preincubated with perforin for 30 mins followed by incubation with [51Cr]-labeled Jurkat cells by gamma counting	ChEMBL.	22244072
Inhibition (binding)	= 73 %	Inhibition of perforin released from human KHYG-1 NK cells assessed as inhibition of perforin-mediated lysis of human K562 cells at 20 uM by [51Cr] release assay in presence of 10% mouse serum	ChEMBL.	22244072
Inhibition (binding)	= 91 %	Inhibition of perforin released from human KHYG-1 NK cells assessed as inhibition of perforin-mediated lysis of human K562 cells at 20 uM by [51Cr] release assay in absence of serum	ChEMBL.	22244072

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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: CHEMBL1934397

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1598984