Detailed information for compound 81130

Basic information

Technical information
  • TDR Targets ID: 81130
  • Name: 2-(9-oxoxanthen-2-yl)oxyethyl thiocyanate
  • MW: 297.328 | Formula: C16H11NO3S
  • H donors: 0 H acceptors: 2 LogP: 3.63 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#CSCCOc1ccc2c(c1)c(=O)c1c(o2)cccc1
  • InChi: 1S/C16H11NO3S/c17-10-21-8-7-19-11-5-6-15-13(9-11)16(18)12-3-1-2-4-14(12)20-15/h1-6,9H,7-8H2
  • InChiKey: AFXJBYLSXXLRTL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • thiocyanic acid 2-[(9-oxo-2-xanthenyl)oxy]ethyl ester
  • thiocyanic acid 2-(9-ketoxanthen-2-yl)oxyethyl ester
  • 2-(2-thiocyanatoethoxy)xanthen-9-one
  • 2-(2-thiocyanatoethoxy)-9-xanthenone
  • 2-(2-thiocyanatoethoxy)xanthone

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
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0018 0.0116 0.0116
Schistosoma mansoni z-protein (S1r protein) 0.0082 0.0906 0.0906
Brugia malayi Nuclear hormone receptor-like 1 0.0009 0.0013 0.0013
Brugia malayi nuclear hormone receptor family member odr-7 0.0008 0.0001 0.0001
Loa Loa (eye worm) beta-lactamase 0.0074 0.0803 0.0803
Schistosoma mansoni retinoic acid receptor RXR 0.0018 0.0116 0.0116
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0009 0.0008 0.0008
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0018 0.0116 0.0116
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0018 0.0116 0.013
Loa Loa (eye worm) G protein-coupled receptor kinase 1 0.0742 0.8992 0.8992
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0013 0.0063 0.0176
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0013 0.0063 0.0176
Schistosoma mansoni flap endonuclease-1 0.0024 0.0194 0.0194
Trichomonas vaginalis glutaminase, putative 0.0281 0.3335 0.9327
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0008 0.0001 0.0001
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0018 0.0116 0.013
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0013 0.0063 0.068
Schistosoma mansoni nuclear receptor 0.0008 0.0001 0.0001
Echinococcus granulosus flap endonuclease 1 0.0027 0.0225 0.025
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0009 0.0013 0.0013
Loa Loa (eye worm) glutathione reductase 0.0039 0.0373 0.0373
Trichomonas vaginalis DNA helicase recq1, putative 0.0022 0.0166 0.0354
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0018 0.0116 0.0116
Schistosoma mansoni rab6-interacting 0.0022 0.0163 0.0163
Plasmodium vivax glutathione reductase, putative 0.0039 0.0373 0.4197
Echinococcus granulosus bloom syndrome protein 0.0022 0.0166 0.0185
Brugia malayi hypothetical protein 0.0008 0.0001 0.0001
Plasmodium vivax thioredoxin reductase, putative 0.0039 0.0373 0.4197
Loa Loa (eye worm) hypothetical protein 0.0022 0.0163 0.0163
Plasmodium vivax multidomain scavenger receptor, putative 0.0022 0.0163 0.1361
Onchocerca volvulus Protein ultraspiracle homolog 0.0018 0.0116 0.0402
Entamoeba histolytica phosphofructokinase, putative 0.0112 0.1264 0.3464
Loa Loa (eye worm) hypothetical protein 0.0018 0.0116 0.0116
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0009 0.0013 0.0013
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0018 0.0116 0.0116
Echinococcus multilocularis regulator of G protein signaling 3 0.0082 0.0906 0.1007
Loa Loa (eye worm) transcription factor SMAD2 0.0123 0.1399 0.1399
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0098 0.1104 0.1853
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0009 0.0013 0.0013
Loa Loa (eye worm) hypothetical protein 0.0009 0.0013 0.0013
Echinococcus granulosus regulator of G protein signaling 7 0.0082 0.0906 0.1007
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0039 0.0373 0.0553
Loa Loa (eye worm) hypothetical protein 0.0018 0.0116 0.0116
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0013 0.0063 0.0176
Echinococcus multilocularis Regulator of G protein signaling 20 0.0082 0.0906 0.1007
Brugia malayi A-kinase anchor protein 10, precursor 0.0082 0.0906 0.0906
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0089 0.0983 0.2018
Echinococcus multilocularis axis inhibition protein axin 0.0082 0.0906 0.1007
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.003 0.0267 0.064
Schistosoma mansoni nuclear receptor 0.0008 0.0001 0.0001
Echinococcus multilocularis regulator of G protein signaling 0.0082 0.0906 0.1007
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0018 0.0116 0.0116
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0357 0.4268 0.4268
Mycobacterium tuberculosis Probable esterase LipL 0.0074 0.0803 0.1318
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0018 0.0116 0.013
Brugia malayi Nuclear hormone receptor E75 0.0008 0.0001 0.0001
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0008 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0008 0.0001 0.0001
Trichomonas vaginalis mercuric reductase, putative 0.0013 0.0063 0.0061
Echinococcus granulosus nuclear receptor nhr 48 0.0008 0.0001 0.0001
Toxoplasma gondii ABC1 family protein 0.0074 0.0803 1
Plasmodium falciparum glutathione reductase 0.0039 0.0373 1
Onchocerca volvulus 0.0022 0.0163 0.0565
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0009 0.0008 0.0009
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0063 0.0176
Mycobacterium tuberculosis Conserved protein 0.0074 0.0803 0.1318
Mycobacterium ulcerans esterase/lipase LipP 0.0074 0.0803 0.2263
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.0906 0.2448
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0018 0.0116 0.0116
Mycobacterium ulcerans lipase LipD 0.0074 0.0803 0.2263
Loa Loa (eye worm) hypothetical protein 0.0074 0.0803 0.0803
Echinococcus granulosus ecdysone induced protein 78C 0.0018 0.0116 0.013
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0009 0.0008 0.0009
Loa Loa (eye worm) hypothetical protein 0.0031 0.0273 0.0273
Trichomonas vaginalis phosphofructokinase, putative 0.0112 0.1264 0.3464
Echinococcus granulosus beta-adrenergic receptor kinase 0.0084 0.093 0.1034
Loa Loa (eye worm) hypothetical protein 0.0009 0.0013 0.0013
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0013 0.0063 0.5
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0013 0.0063 0.0176
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0018 0.0116 0.013
Echinococcus granulosus regulator of G protein signaling 3 0.0082 0.0906 0.1007
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0063 0.0176
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0074 0.0803 0.0803
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0013 0.0063 0.1482
Trichomonas vaginalis glutathione reductase, putative 0.0013 0.0063 0.0061
Trichomonas vaginalis penicillin-binding protein, putative 0.0074 0.0803 0.2158
Schistosoma mansoni blooms syndrome DNA helicase 0.0017 0.011 0.011
Echinococcus granulosus lipoxygenase domain containing protein 0.0022 0.0163 0.0182
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0273 0.0273
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0013 0.0063 0.0176
Brugia malayi Nuclear hormone receptor-like 1 0.0018 0.0116 0.0116
Giardia lamblia Fructose-bisphosphate aldolase 0.03 0.3572 1
Schistosoma mansoni coup transcription factor 0.0018 0.0116 0.0116
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0009 0.0008 0.0009
Echinococcus multilocularis ecdysone induced protein 78C 0.0018 0.0116 0.013
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.001 0.0019 0.0019
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0147 0.1693 0.2901
Echinococcus granulosus regulator of G protein signaling 3 0.0082 0.0906 0.1007
Brugia malayi 6-phosphofructokinase 0.0112 0.1264 0.1264
Brugia malayi hypothetical protein 0.0009 0.0013 0.0013
Loa Loa (eye worm) nuclear receptor NHR-67 0.0008 0.0001 0.0001
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0063 0.0176
Brugia malayi regulator of G-protein signaling egl-10 0.0082 0.0906 0.0906
Echinococcus multilocularis neuropeptide s receptor 0.0475 0.5712 0.6352
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.03 0.3572 1
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0027 0.0225 0.1505
Echinococcus multilocularis bloom syndrome protein 0.0022 0.0166 0.0185
Echinococcus multilocularis regulator of G protein signaling 7 0.0082 0.0906 0.1007
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0013 0.0063 0.0063
Brugia malayi regulator of G-protein signaling rgs-7 0.0082 0.0906 0.0906
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.03 0.3572 1
Echinococcus granulosus FTZ F1 alpha 0.0018 0.0116 0.013
Brugia malayi nuclear hormone receptor 0.0008 0.0001 0.0001
Brugia malayi Pre-SET motif family protein 0.0214 0.2514 0.2514
Loa Loa (eye worm) hypothetical protein 0.0082 0.0906 0.0906
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.03 0.3572 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0163 0.0163
Loa Loa (eye worm) MH2 domain-containing protein 0.0123 0.1399 0.1399
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0018 0.0116 0.0116
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0074 0.0803 0.1318
Echinococcus granulosus axis inhibition protein axin 0.0082 0.0906 0.1007
Schistosoma mansoni nuclear hormone receptor 0.0008 0.0001 0.0001
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0018 0.0116 0.013
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0742 0.8992 0.8992
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0008 0.0008
Echinococcus multilocularis lipoxygenase domain containing protein 0.0022 0.0163 0.0182
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0082 0.0906 0.1007
Echinococcus granulosus [G-protein-coupledreceptor] kinase 0.0742 0.8992 1
Treponema pallidum fructose-bisphosphate aldolase 0.03 0.3572 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0273 0.0304
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0267 0.064
Brugia malayi hypothetical protein 0.0022 0.0163 0.0163
Loa Loa (eye worm) thioredoxin reductase 0.0039 0.0373 0.0373
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.0906 0.2448
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0273 0.0273
Loa Loa (eye worm) hypothetical protein 0.0082 0.0906 0.0906
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0018 0.0116 0.0116
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Schistosoma mansoni hypothetical protein 0.0348 0.4159 0.4159
Echinococcus multilocularis RUN 0.0022 0.0163 0.0182
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0018 0.0116 0.013
Trichomonas vaginalis set domain proteins, putative 0.0243 0.2876 0.8028
Loa Loa (eye worm) hypothetical protein 0.0018 0.0116 0.0116
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0074 0.0803 0.0803
Brugia malayi orphan nuclear receptor NR2E1 0.0008 0.0001 0.0001
Echinococcus granulosus Nuclear hormone receptor HR96 0.0008 0.0001 0.0001
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0074 0.0803 0.0803
Mycobacterium tuberculosis Conserved protein 0.0074 0.0803 0.1318
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0018 0.0116 0.013
Echinococcus granulosus Nuclear hormone receptor HR96 0.0008 0.0001 0.0001
Brugia malayi nuclear hormone receptor family member nhr-6 0.0008 0.0001 0.0001
Brugia malayi Regulator of G protein signaling domain containing protein 0.0082 0.0906 0.0906
Schistosoma mansoni polycystin 1-related 0.0022 0.0163 0.0163
Loa Loa (eye worm) hypothetical protein 0.0082 0.0906 0.0906
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0018 0.0116 0.0116
Entamoeba histolytica hypothetical protein 0.0082 0.0906 0.2448
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0018 0.0116 0.013
Schistosoma mansoni regulator of G protein signaling 0.0082 0.0906 0.0906
Loa Loa (eye worm) hypothetical protein 0.0074 0.0803 0.0803
Mycobacterium tuberculosis Probable hydrolase 0.0074 0.0803 0.1318
Entamoeba histolytica phosphofructokinase, putative 0.0112 0.1264 0.3464
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0074 0.0803 0.2263
Echinococcus multilocularis nuclear receptor nhr 48 0.0008 0.0001 0.0001
Brugia malayi Doublecortin family protein 0.0022 0.0163 0.0163
Schistosoma mansoni regulator of G protein signaling 0.0082 0.0906 0.0906
Brugia malayi nuclear receptor NHR-88 0.0018 0.0116 0.0116
Schistosoma mansoni 6-phosphofructokinase 0.0112 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0009 0.0013 0.0013
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0018 0.0116 0.0116
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0008 0.0001 0.0001
Brugia malayi nuclear receptor NHR-88 0.0008 0.0001 0.0001
Onchocerca volvulus 0.0018 0.0116 0.0402
Trichomonas vaginalis esterase, putative 0.0074 0.0803 0.2158
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0013 0.0063 0.0176
Schistosoma mansoni regulator of G protein signaling 0.0082 0.0906 0.0906
Echinococcus granulosus thioredoxin glutathione reductase 0.0039 0.038 0.0422
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.0082 0.0906 0.2448
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0018 0.0116 0.0116
Loa Loa (eye worm) hypothetical protein 0.0018 0.0116 0.0116
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0009 0.0013 0.0015
Loa Loa (eye worm) hypothetical protein 0.0009 0.0008 0.0008
Trichomonas vaginalis flap endonuclease-1, putative 0.0027 0.0225 0.0521
Schistosoma mansoni RAR-like nuclear receptor 0.0018 0.0116 0.0116
Loa Loa (eye worm) glutaminase 0.0281 0.3335 0.3335
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0027 0.0225 0.1505
Plasmodium falciparum glutathione reductase 0.0013 0.0063 0.1482
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.03 0.3572 1
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0082 0.0906 0.1007
Schistosoma mansoni zinc finger protein 0.0008 0.0001 0.0001
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0013 0.0063 0.0176
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0018 0.0116 0.013
Brugia malayi glutathione reductase 0.0039 0.0373 0.0373
Schistosoma mansoni nuclear hormone receptor 0.0008 0.0001 0.0001
Schistosoma mansoni DNA helicase recq5 0.0009 0.0008 0.0008
Schistosoma mansoni thyroid hormone receptor 0.0018 0.0116 0.0116
Brugia malayi beta-lactamase 0.0074 0.0803 0.0803
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0018 0.0116 0.013
Plasmodium vivax 6-phosphofructokinase, putative 0.003 0.0267 0.276
Loa Loa (eye worm) 6-phosphofructokinase 0.0112 0.1264 0.1264
Schistosoma mansoni glutaminase 0.0281 0.3335 0.3335
Mycobacterium tuberculosis Probable oxidoreductase 0.0098 0.1104 0.1853
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0018 0.0116 0.0116
Brugia malayi PXA domain containing protein 0.0082 0.0906 0.0906
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0008 0.0001 0.0001
Echinococcus granulosus Polycystic kidney disease protein 0.0022 0.0163 0.0182
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0013 0.0063 0.5
Brugia malayi Thioredoxin reductase 0.0039 0.0373 0.0373
Leishmania major trypanothione reductase 0.0039 0.0373 0.2716
Schistosoma mansoni nuclear receptor nhr-48 0.0008 0.0001 0.0001
Echinococcus multilocularis flap endonuclease 1 0.0027 0.0225 0.025
Brugia malayi steroid hormone receptor 0.0018 0.0116 0.0116
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0063 0.0176
Echinococcus granulosus beta LACTamase domain containing family member 0.0074 0.0803 0.0893
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0018 0.0116 0.0116
Entamoeba histolytica hypothetical protein 0.0082 0.0906 0.2448
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0267 0.064
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.03 0.3572 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0039 0.038 0.0422
Trichomonas vaginalis phosphofructokinase, putative 0.0112 0.1264 0.3464
Echinococcus multilocularis neuropeptide receptor A26 0.0475 0.5712 0.6352
Trypanosoma cruzi hypothetical protein, conserved 0.0074 0.0803 0.6229
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.003 0.0267 0.0582
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0013 0.0063 0.1482
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0018 0.0116 0.0116
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0074 0.0803 0.1318
Mycobacterium tuberculosis Probable lipase LipE 0.0074 0.0803 0.1318
Brugia malayi Flap endonuclease-1 0.0027 0.0225 0.0225
Schistosoma mansoni steroid hormone receptor ad4bp 0.0018 0.0116 0.0116
Plasmodium vivax 6-phosphofructokinase, putative 0.003 0.0267 0.276
Trichomonas vaginalis phosphofructokinase, putative 0.0112 0.1264 0.3464
Echinococcus multilocularis Polycystic kidney disease protein 0.0022 0.0163 0.0182
Loa Loa (eye worm) hypothetical protein 0.0074 0.0803 0.0803
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0018 0.0116 0.0402
Brugia malayi photoreceptor-specific nuclear receptor 0.0018 0.0116 0.0116
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0018 0.0116 0.0116
Echinococcus granulosus neuropeptide s receptor 0.0475 0.5712 0.6352
Echinococcus multilocularis regulator of G protein signaling 7 0.0082 0.0906 0.1007
Schistosoma mansoni DNA helicase recq1 0.0009 0.0008 0.0008
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0082 0.0906 0.0906
Echinococcus multilocularis beta LACTamase domain containing family member 0.0074 0.0803 0.0893
Echinococcus multilocularis G protein coupled receptor kinase 6 0.0742 0.8992 1
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.003 0.0267 1
Trichomonas vaginalis phosphofructokinase, putative 0.0112 0.1264 0.3464
Loa Loa (eye worm) PXA domain-containing protein 0.0082 0.0906 0.0906
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0803 0.2158
Echinococcus multilocularis expressed protein 0.0082 0.0906 0.1007
Plasmodium falciparum flap endonuclease 1 0.0027 0.0225 0.5939
Loa Loa (eye worm) phosphofructokinase 0.0112 0.1264 0.1264
Trypanosoma cruzi trypanothione reductase, putative 0.0013 0.0063 0.0176
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.03 0.3572 1
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0267 0.064
Echinococcus multilocularis FTZ F1 alpha 0.0018 0.0116 0.013
Loa Loa (eye worm) hypothetical protein 0.0082 0.0906 0.0906
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0018 0.0116 0.0116
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0018 0.0116 0.013
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0742 0.8992 0.8992
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0015 0.0079 0.0224
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Giardia lamblia NADH oxidase lateral transfer candidate 0.0013 0.0063 0.0152
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0089 0.0983 0.1637
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0082 0.0906 0.0906
Brugia malayi tailless protein 0.0008 0.0001 0.0001
Brugia malayi nuclear receptor RXR 0.0008 0.0001 0.0001
Brugia malayi ecdysteroid receptor 0.0018 0.0116 0.0116
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0018 0.0116 0.0116
Echinococcus multilocularis 6 phosphofructokinase 0.0112 0.1264 0.1406
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0273 0.0273
Brugia malayi nuclear hormone receptor 0.0018 0.0116 0.0116
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0082 0.0906 0.0906
Echinococcus granulosus thyroid hormone receptor alpha 0.0008 0.0001 0.0001
Schistosoma mansoni nuclear hormone receptor 0.0018 0.0116 0.0116
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0803 0.2158
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.03 0.3572 1
Brugia malayi Nuclear hormone receptor-like 1 0.0009 0.0013 0.0013
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0013 0.0063 0.0063
Onchocerca volvulus 0.0074 0.0803 0.279
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0008 0.0001 0.0001
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0112 0.1264 0.2139
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0009 0.0013 0.0015
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0089 0.0983 0.1637
Entamoeba histolytica Flap nuclease, putative 0.0027 0.0225 0.0521
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0098 0.1104 0.1853
Echinococcus multilocularis geminin 0.0348 0.4159 0.4625
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.0273 0.0304
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.003 0.0267 1
Brugia malayi hypothetical protein 0.0008 0.0001 0.0001
Plasmodium vivax hypothetical protein, conserved 0.0074 0.0803 1
Schistosoma mansoni rab6-interacting 0.0022 0.0163 0.0163
Toxoplasma gondii NADPH-glutathione reductase 0.0013 0.0063 0.068
Toxoplasma gondii phosphofructokinase domain-containing protein 0.003 0.0267 0.3253
Brugia malayi hypothetical protein 0.0082 0.0906 0.0906
Brugia malayi 6-phosphofructokinase 0.0112 0.1264 0.1264
Loa Loa (eye worm) hypothetical protein 0.0018 0.0116 0.0116
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0013 0.0063 0.0176
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Onchocerca volvulus 0.0031 0.0273 0.0947
Mycobacterium tuberculosis Probable dehydrogenase 0.0089 0.0983 0.1637
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0018 0.0116 0.013
Brugia malayi Nuclear hormone receptor E75 0.0008 0.0001 0.0001
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.0906 0.2448
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.001 0.0019 0.0019
Echinococcus granulosus regulator of G protein signaling 7 0.0082 0.0906 0.1007
Plasmodium falciparum LCCL domain-containing protein 0.0022 0.0163 0.4244
Echinococcus multilocularis thyroid hormone receptor alpha 0.0018 0.0116 0.013
Plasmodium vivax flap endonuclease 1, putative 0.0027 0.0225 0.2196
Toxoplasma gondii 6-phosphofructokinase 0.003 0.0267 0.3253
Leishmania major ATP-dependent phosphofructokinase 0.0112 0.1264 1
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0267 0.064
Mycobacterium tuberculosis Probable lipase LipD 0.0074 0.0803 0.1318
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0018 0.0116 0.0116
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0063 0.0176
Echinococcus multilocularis axis inhibition protein axin 0.0082 0.0906 0.1007
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.03 0.3572 1
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0031 0.0273 0.333
Schistosoma mansoni serine/threonine protein kinase 0.0084 0.093 0.093
Brugia malayi conserved hypotetical protein 0.0008 0.0001 0.0001
Loa Loa (eye worm) hypothetical protein 0.0018 0.0116 0.0116
Trypanosoma brucei hypothetical protein, conserved 0.0074 0.0803 0.6229
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0472 0.5682 1
Echinococcus granulosus axis inhibition protein axin 0.0082 0.0906 0.1007
Mycobacterium tuberculosis Conserved protein 0.0074 0.0803 0.1318
Schistosoma mansoni loxhd1 0.0022 0.0163 0.0163
Brugia malayi phosphofructokinase 0.0112 0.1264 0.1264
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0273 0.0304
Loa Loa (eye worm) RGS-3 protein 0.0082 0.0906 0.0906
Schistosoma mansoni serine/threonine protein kinase 0.0084 0.093 0.093
Toxoplasma gondii phosphofructokinase PFKII 0.003 0.0267 0.3253
Schistosoma mansoni regulator of G protein signaling 0.0082 0.0906 0.0906
Brugia malayi Steroid receptor seven-up type 2 0.0018 0.0116 0.0116
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0074 0.0803 0.0803
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0112 0.1264 1
Loa Loa (eye worm) RecQ helicase 0.0022 0.0166 0.0166
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0112 0.1264 0.5184
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Echinococcus granulosus neuropeptide receptor A26 0.0475 0.5712 0.6352
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0009 0.0008 0.0009
Echinococcus multilocularis lipoxygenase domain containing protein 0.0022 0.0163 0.0182
Mycobacterium ulcerans glutaminase 0.0281 0.3335 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0018 0.0116 0.0116
Onchocerca volvulus 0.0243 0.2876 1
Brugia malayi Pre-SET motif family protein 0.0031 0.0273 0.0273
Echinococcus granulosus geminin 0.0348 0.4159 0.4625
Onchocerca volvulus 0.0074 0.0803 0.279
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0013 0.0063 0.007
Loa Loa (eye worm) 6-phosphofructokinase 0.0112 0.1264 0.1264
Brugia malayi hypothetical protein 0.0082 0.0906 0.0906
Onchocerca volvulus Bile acid receptor homolog 0.0018 0.0116 0.0402
Loa Loa (eye worm) doublecortin family protein 0.0022 0.0163 0.0163
Loa Loa (eye worm) hypothetical protein 0.0074 0.0803 0.0803
Brugia malayi PXA domain containing protein 0.0082 0.0906 0.0906
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0027 0.0225 0.1505
Brugia malayi hypothetical protein 0.0022 0.0163 0.0163
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0013 0.0063 0.0176
Loa Loa (eye worm) hypothetical protein 0.0074 0.0803 0.0803
Leishmania major hypothetical protein, conserved 0.0074 0.0803 0.6229
Loa Loa (eye worm) hypothetical protein 0.0082 0.0906 0.0906
Trichomonas vaginalis D-aminoacylase, putative 0.0074 0.0803 0.2158
Brugia malayi nuclear receptor RXR 0.0009 0.0013 0.0013
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0019 0.0133 0.3425
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0008 0.00000000063475
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0008 0.0001 0.0001
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.0906 0.2448
Schistosoma mansoni lipoxygenase 0.0022 0.0163 0.0163
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0018 0.0116 0.0116
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0825 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0018 0.0116 0.0116
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0013 0.0063 0.007
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0018 0.0116 0.013
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.003 0.0267 0.0725
Echinococcus multilocularis beta adrenergic receptor kinase 0.0084 0.093 0.1034
Schistosoma mansoni serine/threonine protein kinase 0.0825 1 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0089 0.0983 0.1637
Mycobacterium ulcerans beta-lactamase 0.0074 0.0803 0.2263
Brugia malayi ecdysone receptor 0.0008 0.0001 0.0001
Brugia malayi nuclear receptor NHR-67 0.0008 0.0001 0.0001
Trypanosoma cruzi hypothetical protein, conserved 0.0074 0.0803 0.6229
Loa Loa (eye worm) flap endonuclease-1 0.0027 0.0225 0.0225
Trypanosoma brucei trypanothione reductase 0.0039 0.0373 0.2716
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0018 0.0116 0.0116
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.03 0.3572 1
Loa Loa (eye worm) steroid hormone receptor 0.0018 0.0116 0.0116
Plasmodium falciparum thioredoxin reductase 0.0013 0.0063 0.1482
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.003 0.0267 0.7084
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0084 0.093 0.093
Loa Loa (eye worm) DR-78 0.0008 0.0001 0.0001
Echinococcus granulosus 6 phosphofructokinase 0.0112 0.1264 0.1406
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.03 0.3572 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0074 0.0803 0.2158
Loa Loa (eye worm) hypothetical protein 0.0074 0.0803 0.0803
Trypanosoma cruzi trypanothione reductase, putative 0.0039 0.0373 0.2716
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0009 0.0008 0.0008
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0082 0.0906 0.0906
Loa Loa (eye worm) nuclear hormone receptor 0.0008 0.0001 0.0001
Plasmodium falciparum thioredoxin reductase 0.0039 0.0373 1
Echinococcus multilocularis regulator of G protein signaling 3 0.0082 0.0906 0.1007
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0147 0.1693 1
Brugia malayi Bloom's syndrome protein homolog 0.0022 0.0166 0.0166
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0214 0.2514 0.2514
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0074 0.0803 0.1318
Schistosoma mansoni 6-phosphofructokinase 0.0112 0.1264 0.1264
Schistosoma mansoni axis inhibition protein axin 0.0082 0.0906 0.0906
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0098 0.1104 0.3379
Brugia malayi MH2 domain containing protein 0.0123 0.1399 0.1399
Plasmodium vivax SET domain protein, putative 0.0031 0.0273 0.2843
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0112 0.1264 0.3424
Echinococcus granulosus RUN 0.0022 0.0163 0.0182
Schistosoma mansoni regulator of G protein signaling 0.0082 0.0906 0.0906
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0089 0.0983 0.1637
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Brugia malayi hypothetical protein 0.0009 0.0013 0.0013
Entamoeba histolytica hypothetical protein 0.0082 0.0906 0.2448
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.0906 0.2448
Loa Loa (eye worm) hypothetical protein 0.0018 0.0116 0.0116
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.003 0.0267 0.7084
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0013 0.0063 0.0176
Schistosoma mansoni axis inhibition protein axin 0.0082 0.0906 0.0906
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0027 0.0225 0.2727
Loa Loa (eye worm) hypothetical protein 0.0017 0.0112 0.0112
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0008 0.0001 0.0001
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.003 0.0259 0.0288
Mycobacterium tuberculosis Probable reductase 0.0089 0.0983 0.1637
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0018 0.0116 0.0116
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0018 0.0116 0.0116
Entamoeba histolytica phosphofructokinase, putative 0.0112 0.1264 0.3464
Giardia lamblia Flap structure-specific endonuclease 0.0027 0.0225 0.0608
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0018 0.0116 0.0116
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0273 0.0273
Schistosoma mansoni hypothetical protein 0.0022 0.0163 0.0163
Mycobacterium ulcerans hypothetical protein 0.0074 0.0803 0.2263
Loa Loa (eye worm) glutaminase 2 0.0281 0.3335 0.3335
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0018 0.0116 0.0116
Echinococcus granulosus lipoxygenase domain containing protein 0.0022 0.0163 0.0182
Loa Loa (eye worm) hypothetical protein 0.0009 0.0013 0.0013
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0267 0.064
Onchocerca volvulus 0.0074 0.0803 0.279
Brugia malayi Regulator of G protein signaling domain containing protein 0.0082 0.0906 0.0906
Echinococcus granulosus expressed protein 0.0082 0.0906 0.1007
Loa Loa (eye worm) hypothetical protein 0.0018 0.0116 0.0116
Trichomonas vaginalis DNA helicase recq, putative 0.0022 0.0166 0.0354
Toxoplasma gondii thioredoxin reductase 0.0039 0.0373 0.4592
Loa Loa (eye worm) hypothetical protein 0.0009 0.0013 0.0013
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0147 0.1693 0.4982
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0013 0.0063 0.0176
Loa Loa (eye worm) hypothetical protein 0.0082 0.0906 0.0906
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0008 0.0001 0.0001
Trichomonas vaginalis conserved hypothetical protein 0.0082 0.0906 0.2448
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0112 0.1264 1
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0001
Mycobacterium ulcerans 6-phosphofructokinase 0.0112 0.1264 0.3673
Schistosoma mansoni hypothetical protein 0.0348 0.4159 0.4159
Brugia malayi glutaminase DH11.1 0.0281 0.3335 0.3335
Schistosoma mansoni thyroid hormone receptor 0.0018 0.0116 0.0116
Echinococcus granulosus Regulator of G protein signaling 20 0.0082 0.0906 0.1007
Brugia malayi beta-lactamase family protein 0.0074 0.0803 0.0803
Brugia malayi beta-lactamase family protein 0.0074 0.0803 0.0803
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0015 0.0077 0.0862
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0008 0.0001 0.0001
Onchocerca volvulus 0.0022 0.0163 0.0565
Trichomonas vaginalis 6-phosphofructokinase, putative 0.003 0.0267 0.064
Trichomonas vaginalis phosphofructokinase, putative 0.003 0.0267 0.064

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 54 uM 50% inhibitory concentration against the growth of Trypanosoma cruzi (Epimastigotes) ChEMBL. 10794699
IC50 (functional) = 54 uM 50% inhibitory concentration against the growth of Trypanosoma cruzi (Epimastigotes) ChEMBL. 10794699

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

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.