Detailed information for compound 831882

Basic information

Technical information
  • TDR Targets ID: 831882
  • Name: N'-(3-methylsulfanylphenyl)-N-(12-oxo-7,8,9,1 0-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl )propanediamide
  • MW: 436.527 | Formula: C23H24N4O3S
  • H donors: 2 H acceptors: 3 LogP: 3.45 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSc1cccc(c1)NC(=O)CC(=O)Nc1ccc2c(c1)c(=O)n1c(n2)CCCCC1
  • InChi: 1S/C23H24N4O3S/c1-31-17-7-5-6-15(12-17)24-21(28)14-22(29)25-16-9-10-19-18(13-16)23(30)27-11-4-2-3-8-20(27)26-19/h5-7,9-10,12-13H,2-4,8,11,14H2,1H3,(H,24,28)(H,25,29)
  • InChiKey: PYSFCQGRNAGABP-UHFFFAOYSA-N  

Network

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Synonyms

  • N'-[3-(methylthio)phenyl]-N-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)propanediamide
  • N-(12-keto-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)-N'-[3-(methylthio)phenyl]malonamide

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 Thioredoxin reductase 0.0042 0.0235 0.1426
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0276
Brugia malayi nuclear hormone receptor family member nhr-6 0.0015 0.0032 0.0196
Loa Loa (eye worm) hypothetical protein 0.0028 0.013 0.0793
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0065 0.0405 0.2462
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0096 0.0634 0.0886
Brugia malayi nuclear receptor RXR 0.0017 0.0045 0.0276
Plasmodium falciparum glutathione reductase 0.0042 0.0235 1
Brugia malayi Steroid receptor seven-up type 2 0.0031 0.0155 0.0944
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0174 0.0629
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0143 0.0985 0.4544
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.007 0.0193
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0174 0.1489
Brugia malayi nuclear hormone receptor 0.0015 0.0032 0.0196
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0031 0.0155 0.1329
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0031 0.0155 0.1329
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0065 0.0405 0.3468
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0026 0.0113 0.0685
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0004 0.0023
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0015 0.0031 0.0262
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0015 0.0031 0.0141
Loa Loa (eye worm) glutathione reductase 0.0042 0.0235 0.1426
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0107 0.0714 0.0997
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0031 0.0155 0.0944
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0015 0.0032 0.0276
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0042 0.0235 0.0328
Brugia malayi hypothetical protein 0.0015 0.0032 0.0196
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.136 1 1
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSA 0.0025 0.0107 0.015
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Schistosoma mansoni hypothetical protein 0.0168 0.1167 1
Brugia malayi Blistered cuticle protein 3 0.0027 0.0119 0.0724
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0031 0.0155 0.1329
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Brugia malayi CXXC zinc finger family protein 0.0032 0.0159 0.0969
Brugia malayi nuclear receptor RXR 0.0015 0.0032 0.0196
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.2096 1
Brugia malayi hypothetical protein 0.0017 0.0045 0.0276
Onchocerca volvulus Peroxidasin homolog 0.0027 0.0119 0.0469
Mycobacterium ulcerans polyketide synthase 0.0025 0.0107 0.0107
Trichomonas vaginalis C-MYB, putative 0.002 0.007 0.0193
Brugia malayi Cytochrome P450 family protein 0.0019 0.0064 0.0389
Brugia malayi hypothetical protein 0.015 0.1033 0.6278
Loa Loa (eye worm) acyl carrier protein 0.0013 0.0016 0.0097
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0174 0.1489
Toxoplasma gondii beta-ketoacyl synthase, N-terminal domain-containing protein 0.0018 0.0054 0.0197
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.136 1 1
Mycobacterium tuberculosis Probable polyketide synthase Pks15 0.0011 0.0005 0.0007
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0119 0.0724
Brugia malayi hypothetical protein 0.0027 0.0119 0.0724
Trypanosoma cruzi cytochrome P450, putative 0.0019 0.0064 0.0295
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0107 0.0714 0.0997
Onchocerca volvulus Protein ultraspiracle homolog 0.0031 0.0155 0.0665
Schistosoma mansoni retinoic acid receptor RXR 0.0031 0.0155 0.1329
Mycobacterium ulcerans multifunctional mycocerosic acid synthase membrane-associated Mas 0.0027 0.012 0.012
Onchocerca volvulus Dual oxidase homolog 0.0027 0.0119 0.0469
Loa Loa (eye worm) animal heme peroxidase 0.0027 0.0119 0.0724
Mycobacterium tuberculosis Probable dehydrogenase 0.0096 0.0634 0.0886
Onchocerca volvulus 0.0032 0.0159 0.0687
Mycobacterium tuberculosis Probable thioesterase TesA 0.0023 0.0092 0.0129
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0017 0.0045 0.0389
Giardia lamblia Myb 1-like protein 0.002 0.0071 0.0196
Schistosoma mansoni nuclear receptor 0.0015 0.0032 0.0276
Mycobacterium ulcerans polyketide synthase 0.0027 0.012 0.012
Echinococcus multilocularis ecdysone induced protein 78C 0.0031 0.0155 0.1329
Loa Loa (eye worm) hypothetical protein 0.0031 0.0155 0.0944
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0065 0.0405 0.3468
Onchocerca volvulus Fatty acid synthase homolog 0.005 0.0289 0.1391
Trichomonas vaginalis set domain proteins, putative 0.0264 0.1882 0.8966
Loa Loa (eye worm) cytochrome P450 family protein 0.0029 0.0139 0.0848
Toxoplasma gondii NADPH-glutathione reductase 0.0015 0.0031 0.0111
Leishmania major cytochrome p450-like protein 0.0019 0.0064 0.0295
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0025 0.0107 0.0107
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0202 0.1728
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0107 0.0107
Trichomonas vaginalis pc-MYB2, putative 0.002 0.007 0.0193
Echinococcus multilocularis nuclear receptor nhr 48 0.0015 0.0032 0.0276
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0031 0.0155 0.1329
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0031 0.0155 0.0944
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.0383 0.2763 1
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0015 0.0032 0.0196
Schistosoma mansoni cpg binding protein 0.0032 0.0159 0.1365
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0031 0.0155 0.0944
Mycobacterium tuberculosis Probable polyketide synthase Pks9 0.0016 0.0038 0.0053
Brugia malayi Nuclear hormone receptor E75 0.0015 0.0032 0.0196
Brugia malayi AMP-binding enzyme family protein 0.0026 0.0113 0.0685
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0015 0.0031 0.0186
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0015 0.0032 0.0276
Mycobacterium ulcerans thioesterase TesA 0.0023 0.0092 0.0092
Brugia malayi hypothetical protein 0.0017 0.0045 0.0276
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.2096 1
Trypanosoma brucei trypanothione reductase 0.0042 0.0235 0.1082
Treponema pallidum fructose-bisphosphate aldolase 0.0293 0.2096 0.2071
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0065 0.0405 0.1652
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine 1-carboxyvinyltransferase MurA 0.0976 0.7159 1
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0015 0.0032 0.0276
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0005 0.0041
Loa Loa (eye worm) cytochrome P450 family protein 0.0019 0.0064 0.0389
Brugia malayi oxidoreductase, zinc-binding dehydrogenase family protein 0.005 0.0289 0.176
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0031 0.0155 0.0944
Onchocerca volvulus 0.0034 0.0174 0.0766
Onchocerca volvulus 0.0264 0.1882 1
Brugia malayi Nuclear hormone receptor E75 0.0015 0.0032 0.0196
Mycobacterium ulcerans polyketide synthase Pks9 0.0016 0.0038 0.0038
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0293 0.2096 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0031 0.0155 0.0944
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0276
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0031 0.0155 0.0665
Trichomonas vaginalis C-MYB, putative 0.002 0.007 0.0193
Echinococcus granulosus thyroid hormone receptor alpha 0.0015 0.0032 0.0276
Trichomonas vaginalis MYB, putative 0.002 0.0071 0.0196
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0011 0.0002 0.0011
Trypanosoma cruzi cytochrome P450, putative 0.0019 0.0064 0.0295
Brugia malayi Nuclear hormone receptor-like 1 0.0031 0.0155 0.0944
Schistosoma mansoni peroxidasin 0.0027 0.0119 0.102
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0031 0.0155 0.0944
Leishmania major mitochondrial DNA polymerase beta 0.0303 0.2168 1
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0017 0.0045 0.0389
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0174 0.1489
Schistosoma mansoni cpg binding protein 0.0034 0.0173 0.1481
Toxoplasma gondii thioredoxin reductase 0.0042 0.0235 0.0849
Giardia lamblia Fructose-bisphosphate aldolase 0.0293 0.2096 1
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.0025 0.0107 0.015
Schistosoma mansoni hypothetical protein 0.0013 0.0016 0.0134
Brugia malayi Nuclear hormone receptor-like 1 0.0017 0.0045 0.0276
Mycobacterium tuberculosis Probable polyketide synthase Pks5 0.0027 0.012 0.0167
Loa Loa (eye worm) CXXC zinc finger family protein 0.0032 0.0159 0.0969
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0031 0.0155 0.1329
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0143 0.0985 0.4544
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0015 0.0031 0.0141
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0015 0.0031 0.0031
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.007 0.0193
Echinococcus granulosus Nuclear hormone receptor HR96 0.0015 0.0032 0.0276
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0031 0.0155 0.1329
Brugia malayi hypothetical protein 0.0015 0.0032 0.0196
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.007 0.0193
Toxoplasma gondii type I fatty acid synthase, putative 0.002 0.0067 0.0244
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0031 0.0155 0.1329
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0015 0.0032 0.0276
Toxoplasma gondii histone lysine methyltransferase SET1 0.0062 0.038 0.1376
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0031 0.0155 0.1329
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0096 0.0634 0.0886
Echinococcus granulosus nuclear receptor nhr 48 0.0015 0.0032 0.0276
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0276
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0052 0.0307 0.1417
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0276
Onchocerca volvulus 0.0027 0.0119 0.0469
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.007 0.0193
Echinococcus multilocularis thyroid hormone receptor alpha 0.0031 0.0155 0.1329
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0015 0.0031 0.0141
Mycobacterium leprae Polyketide synthase Pks13 0.0039 0.0208 0.029
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0107 0.0107
Mycobacterium tuberculosis Probable reductase 0.0096 0.0634 0.0886
Trichomonas vaginalis pc-MYB2, putative 0.002 0.007 0.0193
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.2096 1
Plasmodium vivax glutathione reductase, putative 0.0042 0.0235 1
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsA 0.002 0.0067 0.0067
Toxoplasma gondii hypothetical protein 0.0049 0.0285 0.103
Schistosoma mansoni nuclear hormone receptor 0.0015 0.0032 0.0276
Onchocerca volvulus Chorion peroxidase homolog 0.0027 0.0119 0.0469
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0025 0.0107 0.015
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0015 0.0031 0.0141
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0011 0.0002 0.0011
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0015 0.0031 0.0141
Schistosoma mansoni nuclear hormone receptor 0.0031 0.0155 0.1329
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE 0.0016 0.0038 0.0053
Mycobacterium tuberculosis Conserved hypothetical protein 0.016 0.1105 0.1544
Mycobacterium tuberculosis Probable polyketide synthase Pks1 0.002 0.0069 0.0096
Loa Loa (eye worm) DR-78 0.0015 0.0032 0.0196
Brugia malayi Beta-ketoacyl synthase, N-terminal domain containing protein 0.0025 0.0107 0.0651
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Loa Loa (eye worm) animal heme peroxidase 0.0027 0.0119 0.0724
Loa Loa (eye worm) hypothetical protein 0.0017 0.0045 0.0276
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0031 0.0155 0.0944
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0031 0.0155 0.1329
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0031 0.0155 0.1329
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsC 0.0027 0.012 0.012
Schistosoma mansoni peroxidasin 0.0027 0.0119 0.102
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0013 0.0016 0.0134
Loa Loa (eye worm) steroid hormone receptor 0.0031 0.0155 0.0944
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0026 0.0113 0.0157
Brugia malayi nuclear hormone receptor family member odr-7 0.0015 0.0032 0.0196
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0015 0.0031 0.0141
Brugia malayi Cytochrome P450 family protein 0.0019 0.0064 0.0389
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0143 0.0984 0.1374
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0015 0.0031 0.0141
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0031 0.0155 0.0944
Loa Loa (eye worm) animal heme peroxidase 0.0027 0.0119 0.0724
Loa Loa (eye worm) hypothetical protein 0.0031 0.0155 0.0944
Loa Loa (eye worm) hypothetical protein 0.015 0.1033 0.6278
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0119 0.0724
Leishmania major trypanothione reductase 0.0042 0.0235 0.1082
Onchocerca volvulus Bile acid receptor homolog 0.0031 0.0155 0.0665
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0015 0.0031 0.0141
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0031 0.0155 0.1329
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0013 0.0016 0.0134
Schistosoma mansoni nuclear receptor nhr-48 0.0015 0.0032 0.0276
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0143 0.0984 0.1374
Mycobacterium ulcerans polyketide synthase Pks13 0.0039 0.0208 0.0208
Trichomonas vaginalis MYB72, putative 0.002 0.007 0.0193
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0015 0.0031 0.0141
Mycobacterium tuberculosis Phenolpthiocerol synthesis type-I polyketide synthase PpsD 0.0025 0.0107 0.015
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0031 0.0155 0.0944
Brugia malayi Cytochrome P450 family protein 0.0029 0.0139 0.0848
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSD 0.0025 0.0107 0.015
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0015 0.0031 0.0141
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0031 0.0155 0.1329
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0017 0.0045 0.0389
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0238 0.1099
Echinococcus granulosus FTZ F1 alpha 0.0031 0.0155 0.1329
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0031 0.0155 0.1329
Echinococcus granulosus thioredoxin glutathione reductase 0.0043 0.0239 0.2045
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0015 0.0031 0.0141
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0015 0.0031 0.0043
Loa Loa (eye worm) hypothetical protein 0.0013 0.0018 0.0107
Schistosoma mansoni RAR-like nuclear receptor 0.0031 0.0155 0.1329
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0015 0.0031 0.0031
Brugia malayi nuclear receptor NHR-88 0.0015 0.0032 0.0196
Plasmodium vivax ataxin-2 like protein, putative 0.0028 0.013 0.4894
Mycobacterium ulcerans Type I modular polyketide synthase 0.0025 0.0107 0.0107
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.013 0.0601
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0031 0.0155 0.1329
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.0071 0.0196
Brugia malayi Pre-SET motif family protein 0.0034 0.0174 0.1057
Echinococcus granulosus ecdysone induced protein 78C 0.0031 0.0155 0.1329
Brugia malayi nuclear receptor NHR-88 0.0031 0.0155 0.0944
Brugia malayi Nuclear hormone receptor-like 1 0.0017 0.0045 0.0276
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0174 0.1489
Loa Loa (eye worm) hypothetical protein 0.0044 0.0246 0.1493
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSB 0.002 0.0067 0.0094
Toxoplasma gondii type I fatty acid synthase, putative 0.0027 0.012 0.0433
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0031 0.0155 0.1329
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0096 0.0634 0.0886
Loa Loa (eye worm) hypothetical protein 0.0034 0.0174 0.1057
Trypanosoma cruzi PAB1-binding protein , putative 0.0028 0.013 0.0601
Mycobacterium ulcerans hypothetical protein 0.016 0.1105 0.1105
Brugia malayi hypothetical protein 0.0018 0.0057 0.0345
Brugia malayi Peroxidasin 0.0027 0.0119 0.0724
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0015 0.0031 0.0141
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0031 0.0155 0.0944
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0015 0.0031 0.0262
Loa Loa (eye worm) CYP4Cod1 0.0019 0.0064 0.0389
Brugia malayi ecdysteroid receptor 0.0031 0.0155 0.0944
Echinococcus multilocularis FTZ F1 alpha 0.0031 0.0155 0.1329
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0174 0.1489
Echinococcus multilocularis peroxidasin 0.0027 0.0119 0.102
Toxoplasma gondii LsmAD domain-containing protein 0.0028 0.013 0.0472
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0015 0.0032 0.0196
Loa Loa (eye worm) nuclear hormone receptor 0.0015 0.0032 0.0196
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.0383 0.2763 0.2763
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0303 0.2168 1
Brugia malayi Pre-SET motif family protein 0.0232 0.1645 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0174 0.1489
Schistosoma mansoni zinc finger protein 0.0015 0.0032 0.0276
Onchocerca volvulus 0.0048 0.0277 0.1322
Mycobacterium tuberculosis Polyketide synthase Pks13 0.0039 0.0208 0.029
Loa Loa (eye worm) nuclear receptor NHR-67 0.0015 0.0032 0.0196
Onchocerca volvulus 0.0027 0.0119 0.0469
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0015 0.0031 0.0141
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0065 0.0405 0.1868
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Echinococcus multilocularis geminin 0.0168 0.1167 1
Brugia malayi ecdysone receptor 0.0015 0.0032 0.0196
Echinococcus multilocularis thioredoxin glutathione reductase 0.0043 0.0239 0.2045
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0232 0.1645 1
Onchocerca volvulus 0.0027 0.0119 0.0469
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0031 0.0155 0.0944
Onchocerca volvulus Peroxidase homolog 0.0027 0.0119 0.0469
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0143 0.0985 0.4544
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0174 0.1489
Brugia malayi tailless protein 0.0015 0.0032 0.0196
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Mycobacterium leprae PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSC 0.0027 0.012 0.0167
Loa Loa (eye worm) hypothetical protein 0.0031 0.0155 0.0944
Toxoplasma gondii Myb family DNA-binding domain-containing protein 0.002 0.0071 0.0257
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.013 0.4894
Schistosoma mansoni thyroid hormone receptor 0.0031 0.0155 0.1329
Trypanosoma cruzi trypanothione reductase, putative 0.0015 0.0031 0.0141
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.007 0.0193
Echinococcus multilocularis cpg binding protein 0.0034 0.0173 0.1481
Mycobacterium ulcerans thioesterase 0.0023 0.0092 0.0092
Brugia malayi orphan nuclear receptor NR2E1 0.0015 0.0032 0.0196
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.0383 0.2763 0.2741
Mycobacterium leprae PROBABLE UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE MURA 0.0976 0.7159 1
Mycobacterium leprae Probable multifunctional mycocerosic acid synthase membrane associated enzyme Mas 0.0027 0.012 0.0167
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0015 0.0032 0.0276
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0019 0.0064 0.0064
Mycobacterium tuberculosis Probable polyketide synthase Pks8 0.002 0.007 0.0098
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0015 0.0032 0.0276
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0202 0.1728
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0405 0.1868
Mycobacterium tuberculosis Polyketide synthase Pks12 0.0027 0.012 0.0167
Loa Loa (eye worm) hypothetical protein 0.0031 0.0155 0.0944
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0015 0.0031 0.0262
Loa Loa (eye worm) cytochrome P450 family protein 0.0019 0.0064 0.0389
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0015 0.0032 0.0276
Brugia malayi nuclear hormone receptor 0.0031 0.0155 0.0944
Loa Loa (eye worm) fatty acid synthase 0.0027 0.0123 0.075
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0405 0.1868
Schistosoma mansoni hypothetical protein 0.0168 0.1167 1
Mycobacterium leprae Probable polyketide synthase Pks1 0.0027 0.012 0.0167
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0015 0.0032 0.0276
Brugia malayi steroid hormone receptor 0.0031 0.0155 0.0944
Mycobacterium tuberculosis Probable oxidoreductase 0.0107 0.0714 0.0997
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0015 0.0031 0.0111
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0014 0.0025 0.0092
Loa Loa (eye worm) hypothetical protein 0.0031 0.0155 0.0944
Mycobacterium tuberculosis Probable membrane bound polyketide synthase Pks6 0.0039 0.0208 0.029
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0303 0.2168 1
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0065 0.0405 0.3468
Schistosoma mansoni steroid hormone receptor ad4bp 0.0031 0.0155 0.1329
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Echinococcus granulosus geminin 0.0168 0.1167 1
Brugia malayi conserved hypotetical protein 0.0015 0.0032 0.0196
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0238 0.1099
Brugia malayi hypothetical protein 0.0028 0.013 0.0793
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsB 0.002 0.0067 0.0067
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0015 0.0031 0.0031
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.007 0.0193
Loa Loa (eye worm) animal heme peroxidase 0.0027 0.0119 0.0724
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0043 0.0238 0.1099
Onchocerca volvulus 0.015 0.1033 0.5408
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Loa Loa (eye worm) thioredoxin reductase 0.0042 0.0235 0.1426
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0096 0.0634 0.0886
Loa Loa (eye worm) hypothetical protein 0.0031 0.0155 0.0944
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0143 0.0984 0.0984
Schistosoma mansoni thyroid hormone receptor 0.0031 0.0155 0.1329
Mycobacterium ulcerans phenolpthiocerol synthesis type-I polyketide synthase PpsE 0.0016 0.0038 0.0038
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0031 0.0155 0.0944
Schistosoma mansoni coup transcription factor 0.0031 0.0155 0.1329
Brugia malayi nuclear receptor NHR-67 0.0015 0.0032 0.0196
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0005 0.0029
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0031 0.0155 0.1329
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0119 0.0724
Echinococcus granulosus cpg binding protein 0.0034 0.0173 0.1481
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0303 0.2168 1
Trichomonas vaginalis MYB3r3, putative 0.002 0.007 0.0193
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0107 0.0714 0.0997
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.136 1 1
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0015 0.0032 0.0276
Mycobacterium leprae PROBABLE THIOESTERASE TESA 0.0023 0.0092 0.0129
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0031 0.0155 0.0944
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.2096 1
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0119 0.0724
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0015 0.0031 0.0141
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0031 0.0155 0.1329
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.2096 1
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.0383 0.2763 0.386
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0031 0.0155 0.0944
Onchocerca volvulus Peroxidasin homolog 0.0027 0.0119 0.0469
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.016 0.1368
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0065 0.0405 0.2462
Schistosoma mansoni cpg binding protein 0.0034 0.0173 0.1481
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0031 0.0155 0.0944
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0031 0.0155 0.0944
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0031 0.0155 0.0944
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0015 0.0031 0.0141
Trypanosoma brucei PAB1-binding protein , putative 0.0028 0.013 0.0601
Mycobacterium tuberculosis Probable polyketide synthase Pks7 0.0027 0.012 0.0167
Brugia malayi Animal haem peroxidase family protein 0.0027 0.0119 0.0724
Brugia malayi photoreceptor-specific nuclear receptor 0.0031 0.0155 0.0944
Echinococcus granulosus Nuclear hormone receptor HR96 0.0015 0.0032 0.0276
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0031 0.0155 0.1329
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0005 0.0041
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0043 0.0238 0.1099
Schistosoma mansoni nuclear receptor 0.0015 0.0032 0.0276
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.002 0.0071 0.0196
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0015 0.0031 0.0141
Plasmodium falciparum thioredoxin reductase 0.0042 0.0235 1
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0405 0.1868
Onchocerca volvulus 0.0026 0.0113 0.0435
Echinococcus granulosus peroxidasin 0.0027 0.0119 0.102
Plasmodium vivax thioredoxin reductase, putative 0.0042 0.0235 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0031 0.0155 0.0944
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0017 0.0045 0.0389
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.2096 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0031 0.0155 0.1329
Plasmodium vivax SET domain protein, putative 0.0034 0.0174 0.7027
Loa Loa (eye worm) hypothetical protein 0.0015 0.0032 0.0196
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0069 0.0434 0.3718
Mycobacterium tuberculosis Probable multifunctional mycocerosic acid synthase membrane-associated Mas 0.0027 0.012 0.0167
Leishmania major hypothetical protein, conserved 0.0028 0.013 0.0601
Loa Loa (eye worm) blistered cuticle protein 3 0.0027 0.0119 0.0724
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Trypanosoma brucei cytochrome P450, putative 0.0019 0.0064 0.0295
Loa Loa (eye worm) hypothetical protein 0.0031 0.0155 0.0944
Onchocerca volvulus 0.0031 0.0155 0.0665
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0017 0.0045 0.0276
Onchocerca volvulus Peroxidase homolog 0.0027 0.0119 0.0469
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0031 0.0155 0.0944
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0031 0.0155 0.0944
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.2096 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0155 0.0944
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0293 0.2096 1
Loa Loa (eye worm) hypothetical protein 0.0027 0.0119 0.0724
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0293 0.2096 1
Trypanosoma cruzi trypanothione reductase, putative 0.0042 0.0235 0.1082
Brugia malayi glutathione reductase 0.0042 0.0235 0.1426
Schistosoma mansoni nuclear hormone receptor 0.0015 0.0032 0.0276
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0096 0.0634 0.0886
Plasmodium falciparum ataxin-2 like protein, putative 0.0028 0.013 0.4894
Mycobacterium tuberculosis Polyketide synthase Pks2 0.0027 0.012 0.0167

Activities

No activities found for this compound.

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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