Detailed information for compound 806685

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 385.5 | Formula: C22H31N3O3
  • H donors: 1 H acceptors: 3 LogP: 3.87 Rotable bonds: 11
    Rule of 5 violations (Lipinski): 1
  • SMILES: C=CCN(C(=O)c1cn(cc(c1=O)C(=O)NC(CC)C)C1CCCC1)CC=C
  • InChi: 1S/C22H31N3O3/c1-5-12-24(13-6-2)22(28)19-15-25(17-10-8-9-11-17)14-18(20(19)26)21(27)23-16(4)7-3/h5-6,14-17H,1-2,7-13H2,3-4H3,(H,23,27)
  • InChiKey: MOHNEMGPILEUPP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0007 0.0069 0.0085
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtF 0.0007 0.0069 0.0592
Entamoeba histolytica acyl-coA synthetase, putative 0.0025 0.1092 0.201
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0112 0.6236 0.8943
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.5417 0.7413
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0261 0.0257
Schistosoma mansoni chromatin regulatory protein sir2 0.0017 0.0648 0.0644
Brugia malayi Aspartyl aminopeptidase 0.0074 0.4032 0.4699
Echinococcus granulosus Smad4 0.0008 0.014 0.0136
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.5417 0.7413
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0016 0.0609 0.0861
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0726 0.1029
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0049 0.2533 0.3625
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0069 0.0592
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.1092 0.201
Echinococcus granulosus chromatin regulatory protein sir2 0.0017 0.0648 0.0644
Schistosoma mansoni smad1 5 8 and 0.0008 0.014 0.0136
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0017 0.0645 0.5
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0609 0.0605
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0261 0.0257
Entamoeba histolytica aminopeptidase, putative 0.0074 0.4032 0.7441
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0261 0.0257
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.0645 0.1183
Echinococcus multilocularis NAD dependent deacetylase sirtuin 6 0.0017 0.0648 0.0644
Entamoeba histolytica acyl-CoA synthetase, putative 0.0025 0.1092 0.201
Plasmodium falciparum transcriptional regulatory protein sir2a 0.0017 0.0648 0.1597
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0609 0.2391
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0667 0.0944
Toxoplasma gondii histone deacetylase SIR2 0.0017 0.0648 0.2544
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0779
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.013 0.7283 1
Schistosoma mansoni kinase 0.005 0.2577 0.2574
Schistosoma mansoni aspartyl aminopeptidase (M18 family) 0.0074 0.4032 0.4029
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0007 0.0069 0.0119
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.1092 0.1555
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0726 1
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0112 0.6236 0.8934
Schistosoma mansoni hypothetical protein 0.0016 0.0607 0.0603
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0017 0.0645 0.159
Plasmodium vivax M18 aspartyl aminopeptidase, putative 0.0074 0.4032 1
Echinococcus multilocularis GPCR, family 2 0.0016 0.0607 0.0603
Loa Loa (eye worm) hypothetical protein 0.0113 0.6278 0.7363
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0609 0.0605
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0645 0.1183
Mycobacterium tuberculosis Probable oxidoreductase 0.0124 0.6971 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0044 0.2248 0.8873
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0044 0.2248 0.3021
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0607 0.0639
Trypanosoma cruzi aspartyl aminopeptidase, putative 0.0074 0.4032 0.7441
Brugia malayi MH2 domain containing protein 0.0124 0.694 0.8148
Entamoeba histolytica hypothetical protein, conserved 0.0017 0.0648 0.1189
Mycobacterium ulcerans hypothetical protein 0.0025 0.1092 1
Echinococcus multilocularis chromatin regulatory protein sir2 0.0017 0.0648 0.0644
Schistosoma mansoni aspartyl aminopeptidase (M18 family) 0.0074 0.4032 0.4029
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0261 0.0257
Toxoplasma gondii histone deacetylase SIR2-like 0.0017 0.0648 0.2544
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.014 0.0136
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.694 0.8148
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.2439 0.2436
Brugia malayi alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase 0.0012 0.0379 0.0368
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0261 0.0228
Plasmodium vivax acetyl-CoA synthetase, putative 0.0007 0.0069 0.016
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0261 0.0228
Trypanosoma cruzi polo-like protein kinase, putative 0.0098 0.5417 1
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0261 0.0257
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0261 0.0228
Mycobacterium ulcerans NAD-dependent deacetylase 0.0017 0.0648 0.5913
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0261 0.0228
Giardia lamblia NADH oxidase lateral transfer candidate 0.0017 0.0645 0.0885
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0779
Schistosoma mansoni Smad4 0.0008 0.014 0.0136
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0261 0.0257
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0261 0.0228
Plasmodium falciparum transcriptional regulatory protein sir2b 0.0017 0.0648 0.1597
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.015 0.8502 0.8501
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0261 0.0359
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.014 0.0085
Loa Loa (eye worm) hypothetical protein 0.001 0.0261 0.0228
Toxoplasma gondii AMP-binding enzyme domain-containing protein 0.0007 0.0069 0.0255
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.015 0.8502 0.8501
Plasmodium falciparum dihydrolipoyl dehydrogenase, mitochondrial 0.0017 0.0645 0.159
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0007 0.0069 0.0085
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.1092 1
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0261 0.0257
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0261 0.0228
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.013 0.7283 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.1092 0.1483
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0261 0.0257
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0035 0.17 0.2261
Schistosoma mansoni thyroid hormone receptor 0.001 0.0261 0.0257
Loa Loa (eye worm) hypothetical protein 0.0074 0.4032 0.4699
Leishmania major acetyl-CoA synthetase, putative 0.0007 0.0069 0.0119
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0607 0.0603
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0779
Giardia lamblia Kinase, PLK 0.0098 0.5417 0.7438
Mycobacterium ulcerans bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ACP synthetase 0.0007 0.0069 0.0592
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0069 0.0592
Loa Loa (eye worm) hypothetical protein 0.0025 0.1092 0.1214
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0069 0.0592
Trypanosoma brucei aspartyl aminopeptidase, putative 0.0074 0.4032 0.7441
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.2439 0.2436
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0074 0.4032 0.5493
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0017 0.0648 0.0802
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0007 0.0069 0.0085
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0261 0.0228
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0261 0.0257
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.014 0.0136
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0007 0.0069 0.0085
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0017 0.0648 0.0802
Entamoeba histolytica Sir2 family transcriptional regulator, putative 0.0017 0.0648 0.1189
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0779
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.014 0.0136
Brugia malayi isocitrate dehydrogenase 0.0016 0.0609 0.0641
Trypanosoma brucei long-chain-fatty-acid-CoA ligase, putative 0.0007 0.0069 0.0119
Mycobacterium tuberculosis Probable dehydrogenase 0.0112 0.6236 0.8943
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0261 0.0257
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0645 0.1183
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.2439 0.2436
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0261 0.0257
Mycobacterium ulcerans acetyl-CoA synthetase 0.0007 0.0069 0.0592
Loa Loa (eye worm) hypothetical protein 0.0018 0.0726 0.0779
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0261 0.0228
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0007 0.0069 0.0592
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.1092 0.201
Schistosoma mansoni chromatin regulatory protein sir2 0.0017 0.0648 0.0644
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0017 0.0648 0.0802
Brugia malayi nuclear receptor NHR-88 0.001 0.0261 0.0228
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.17 0.2261
Schistosoma mansoni hypothetical protein 0.0016 0.0607 0.0603
Leishmania major long-chain-fatty-acid-CoA ligase, putative 0.0007 0.0069 0.0119
Mycobacterium ulcerans Sir2-like regulatory protein 0.0017 0.0648 0.5913
Brugia malayi acetyltransferase, GNAT family protein 0.015 0.8502 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0261 0.0228
Brugia malayi glutathione reductase 0.0049 0.2533 0.2922
Schistosoma mansoni acetyl-CoA synthetase 0.0007 0.0069 0.0064
Entamoeba histolytica long-chain-fatty-acid--CoA ligase, putative 0.0007 0.0069 0.0119
Mycobacterium tuberculosis Probable reductase 0.0112 0.6236 0.8943
Brugia malayi MH2 domain containing protein 0.0008 0.014 0.0085
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0017 0.0645 0.0641
Plasmodium falciparum thioredoxin reductase 0.0017 0.0645 0.159
Leishmania major silent information regulator 2, putative 0.0017 0.0648 0.1189
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0007 0.0069 0.0085
Echinococcus multilocularis NAD dependent deacetylase sirtuin 1 0.013 0.7283 0.7282
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0261 0.0257
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.1092 1
Echinococcus multilocularis NAD dependent deacetylase sirtuin 7 0.0017 0.0648 0.0644
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0069 0.0592
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0261 0.0257
Brugia malayi transcriptional regulator, Sir2 family protein 0.0017 0.0648 0.0686
Leishmania major sir2-family protein-like protein 0.0017 0.0648 0.1189
Trypanosoma brucei Silent information regulator 2 related protein 3 0.0017 0.0648 0.1189
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0261 0.0228
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0261 0.0228
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0017 0.0648 0.0802
Loa Loa (eye worm) hypothetical protein 0.001 0.0261 0.0228
Plasmodium falciparum acyl-CoA synthetase 0.0018 0.0726 0.1792
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0017 0.0648 0.0802
Giardia lamblia Sirtuin type 2 0.0017 0.0648 0.0889
Loa Loa (eye worm) transcriptional regulator 0.0017 0.0648 0.0686
Brugia malayi steroid hormone receptor 0.001 0.0261 0.0228
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.0645 0.1183
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0017 0.0645 0.159
Toxoplasma gondii Acetyl-coenzyme A synthetase 2, putative 0.0007 0.0069 0.0255
Schistosoma mansoni hypothetical protein 0.0016 0.0607 0.0603
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.2439 0.2811
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0007 0.0069 0.0119
Loa Loa (eye worm) glutathione reductase 0.0049 0.2533 0.2922
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0069 0.0592
Loa Loa (eye worm) sirtuin 4 0.0017 0.0648 0.0686
Plasmodium vivax NAD-dependent deacetylase, putative 0.0017 0.0648 0.1597
Brugia malayi ecdysteroid receptor 0.001 0.0261 0.0228
Mycobacterium ulcerans peptide synthetase Nrp (peptide synthase) 0.0007 0.0069 0.0592
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0261 0.0257
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.1092 0.201
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0261 0.0228
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0016 0.0609 0.1501
Entamoeba histolytica acetyltransferase, GNAT family 0.0041 0.2031 0.3745
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.1092 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0124 0.6971 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0049 0.2533 0.253
Loa Loa (eye worm) hypothetical protein 0.0035 0.1726 0.1965
Trypanosoma brucei SIR2-like protein 4, putative 0.0017 0.0648 0.1189
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0261 0.0228
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.2439 0.2436
Leishmania major aspartyl aminopeptidase, putative,metallo-peptidase, Clan MH, Family M20 0.0074 0.4032 0.7441
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.5417 0.7413
Brugia malayi Calcitonin receptor-like protein seb-1 0.0052 0.269 0.3108
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0052 0.269 0.3108
Echinococcus granulosus FTZ F1 alpha 0.001 0.0261 0.0257
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0007 0.0069 0.0085
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0016 0.0609 0.1117
Schistosoma mansoni hypothetical protein 0.0035 0.1726 0.1723
Trypanosoma brucei polo-like protein kinase 0.0098 0.5417 1
Echinococcus multilocularis aspartyl aminopeptidase 0.0074 0.4032 0.4029
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0261 0.0228
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.013 0.7283 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0607 0.0639
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0069 0.0592
Echinococcus granulosus NAD dependent deacetylase sirtuin 6 0.0017 0.0648 0.0644
Plasmodium falciparum thioredoxin reductase 0.0049 0.2533 0.628
Brugia malayi AMP-binding enzyme family protein 0.0025 0.1092 0.1214
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0017 0.0645 0.0683
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.5417 0.7413
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0261 0.0228
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0261 0.0257
Schistosoma mansoni chromatin regulatory protein sir2 0.0017 0.0648 0.0644
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.17 0.2261
Schistosoma mansoni nuclear hormone receptor 0.001 0.0261 0.0257
Trypanosoma cruzi acetyl-CoA synthetase, putative 0.0007 0.0069 0.0119
Schistosoma mansoni smad1 5 8 and 0.0008 0.014 0.0136
Loa Loa (eye worm) hypothetical protein 0.001 0.0261 0.0228
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.0645 0.1183
Trichomonas vaginalis conserved hypothetical protein 0.0035 0.17 0.2261
Schistosoma mansoni hypothetical protein 0.0016 0.0607 0.0603
Trypanosoma brucei Silent information regulator 2 related protein 1 0.0017 0.0648 0.1189
Brugia malayi Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein 0.0012 0.0379 0.0368
Trypanosoma cruzi polo-like protein kinase, putative 0.0098 0.5417 1
Plasmodium falciparum glutathione reductase 0.0049 0.2533 0.628
Brugia malayi Thioredoxin reductase 0.0049 0.2533 0.2922
Loa Loa (eye worm) hypothetical protein 0.001 0.0261 0.0228
Brugia malayi MH2 domain containing protein 0.0008 0.014 0.0085
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0052 0.269 0.3108
Loa Loa (eye worm) transcriptional regulator 0.0017 0.0648 0.0686
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0007 0.0069 0.0085
Entamoeba histolytica Sir2 family transcriptional regulator, putative 0.0017 0.0648 0.1189
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.2439 0.2811
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0645 0.1183
Echinococcus granulosus thioredoxin glutathione reductase 0.0049 0.2533 0.253
Loa Loa (eye worm) hypothetical protein 0.013 0.7283 0.8554
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.013 0.7283 1
Plasmodium vivax thioredoxin reductase, putative 0.0049 0.2533 0.628
Echinococcus multilocularis Smad4 0.0008 0.014 0.0136
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.014 0.0136
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.014 0.0136
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.1092 1
Entamoeba histolytica serine/threonine protein kinase, putative 0.0098 0.5417 1
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0044 0.2248 0.5572
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0124 0.6971 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0261 0.0228
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0007 0.0069 0.0064
Echinococcus granulosus NAD dependent deacetylase sirtuin 3 0.0017 0.0648 0.0644
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0035 0.17 0.2261
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0017 0.0648 0.0802
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0261 0.0257
Entamoeba histolytica Sir2 family transcriptional regulator, putative 0.0017 0.0648 0.1189
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0607 0.0603
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0645 0.1183
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0607 0.0603
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0098 0.5417 0.5415
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0645 0.1183
Loa Loa (eye worm) transcriptional regulator 0.0017 0.0648 0.0686
Plasmodium falciparum histone acetyltransferase GCN5 0.0041 0.2031 0.5033
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0017 0.0645 0.1183
Trypanosoma brucei acetyl-CoA synthetase, putative 0.0007 0.0069 0.0119
Schistosoma mansoni chromatin regulatory protein sir2 0.0017 0.0648 0.0644
Entamoeba histolytica NAD-dependent deacetylase 1, putative 0.0017 0.0648 0.1189
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0017 0.0645 0.0641
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0261 0.0257
Plasmodium vivax acyl-CoA synthetase, putative 0.0018 0.0726 0.1792
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0261 0.0257
Leishmania major trypanothione reductase 0.0049 0.2533 0.4673
Plasmodium falciparum dihydrolipoyl dehydrogenase, apicoplast 0.0017 0.0645 0.159
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0261 0.0228
Trypanosoma cruzi Silent information regulator 2 related protein 1 0.0017 0.0648 0.1189
Echinococcus multilocularis NAD dependent deacetylase sirtuin 3 0.0017 0.0648 0.0644
Wolbachia endosymbiont of Brugia malayi dihydrolipoamide dehydrogenase E3 component 0.0017 0.0645 0.5
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0017 0.0645 0.2533
Schistosoma mansoni chromatin regulatory protein sir2 0.0017 0.0648 0.0644
Schistosoma mansoni coup transcription factor 0.001 0.0261 0.0257
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.694 0.8148
Treponema pallidum NADH oxidase 0.0017 0.0645 0.5
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0074 0.4032 0.5493
Trypanosoma brucei aspartyl aminopeptidase, putative 0.0074 0.4032 0.7441
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.5417 0.7413
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0025 0.1092 0.1483
Mycobacterium tuberculosis Probable aminopeptidase PepC 0.0074 0.4032 0.5777
Plasmodium vivax hypothetical protein, conserved 0.0017 0.0648 0.1597
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0261 0.0359
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0017 0.0645 0.5887
Trypanosoma cruzi Silent information regulator 2 related protein 3 0.0017 0.0648 0.1189
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0607 0.0603
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0609 0.0605
Echinococcus granulosus histone acetyltransferase KAT2B 0.0044 0.2248 0.2245
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0017 0.0645 0.5887
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.1092 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0261 0.0228
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0017 0.0645 0.1183
Loa Loa (eye worm) hypothetical protein 0.001 0.0261 0.0228
Onchocerca volvulus 0.001 0.0261 0.0359
Loa Loa (eye worm) hypothetical protein 0.0025 0.1092 0.1214
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0112 0.6236 0.8943
Plasmodium vivax glutathione reductase, putative 0.0049 0.2533 0.628
Brugia malayi nuclear hormone receptor 0.001 0.0261 0.0228
Mycobacterium tuberculosis Transcriptional regulatory protein 0.0017 0.0648 0.0916
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0098 0.5417 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0146 0.8253 0.8253
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0016 0.0609 0.1501
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0016 0.0609 0.0605
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0007 0.0069 0.0085
Loa Loa (eye worm) hypothetical protein 0.001 0.0261 0.0228
Brugia malayi serine/threonine-protein kinase plk-2 0.0098 0.5417 0.6341
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0645 0.1183
Schistosoma mansoni hypothetical protein 0.0176 1 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0018 0.0726 0.6633
Mycobacterium tuberculosis Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot 0.0017 0.0645 0.0912
Schistosoma mansoni serine/threonine protein kinase 0.0098 0.5417 0.5415
Trypanosoma cruzi long-chain-fatty-acid-CoA ligase, putative 0.0007 0.0069 0.0119
Plasmodium falciparum acetyl-CoA synthetase, putative 0.0007 0.0069 0.016
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.1092 1
Giardia lamblia Transcriptional regulator, Sir2 family 0.0017 0.0648 0.0889
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0035 0.17 0.2261
Trichomonas vaginalis mercuric reductase, putative 0.0017 0.0645 0.0798
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0007 0.0069 0.0085
Loa Loa (eye worm) hypothetical protein 0.0052 0.269 0.3108
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0645 0.1183
Brugia malayi transcriptional regulator, Sir2 family protein 0.0017 0.0648 0.0686
Brugia malayi Smad1 0.0008 0.014 0.0085
Onchocerca volvulus 0.0025 0.1092 0.1914
Brugia malayi AMP-binding enzyme family protein 0.0025 0.1092 0.1214
Echinococcus multilocularis smad 0.0008 0.014 0.0136
Brugia malayi transcriptional regulator, Sir2 family protein 0.0017 0.0648 0.0686
Loa Loa (eye worm) hypothetical protein 0.001 0.0261 0.0228
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0645 0.1183
Toxoplasma gondii NADPH-glutathione reductase 0.0017 0.0645 0.2533
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0607 0.0639
Giardia lamblia Histone acetyltransferase GCN5 0.0041 0.2031 0.2789
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0124 0.6971 1
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0609 0.0641
Loa Loa (eye worm) hypothetical protein 0.0025 0.1092 0.1214
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.2439 0.2436
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0261 0.0257
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0069 0.0592
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0098 0.5417 0.5415
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0261 0.0257
Brugia malayi NAD-dependent deacetylase SIRT1 0.013 0.7283 0.8554
Mycobacterium ulcerans phenyloxazoline synthase MbtB 0.0007 0.0069 0.0592
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0112 0.6236 0.8943
Mycobacterium leprae PROBABLE AMINOPEPTIDASE PEPC 0.0074 0.4032 0.5741
Leishmania major NAD dependent deacetylase, putative,transcriptional regulator, Sir2 family protein, nicotinic acid mononucleotide 5,6-dimethylbe 0.0017 0.0648 0.1189
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.1092 1
Trichomonas vaginalis bromodomain-containing protein, putative 0.0044 0.2248 0.3021
Toxoplasma gondii thioredoxin reductase 0.0049 0.2533 1
Brugia malayi AMP-binding enzyme family protein 0.0025 0.1092 0.1214
Trypanosoma cruzi trypanothione reductase, putative 0.0049 0.2533 0.4673
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0007 0.0069 0.0085
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0007 0.0069 0.0085
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0261 0.0257
Echinococcus granulosus aspartyl aminopeptidase 0.0074 0.4032 0.4029
Trichomonas vaginalis CAMK family protein kinase 0.0048 0.2501 0.3372
Brugia malayi MH1 domain containing protein 0.0008 0.014 0.0085
Trypanosoma cruzi trypanothione reductase, putative 0.0017 0.0645 0.1183
Schistosoma mansoni smad1 5 8 and 0.0008 0.014 0.0136
Schistosoma mansoni smad 0.0008 0.014 0.0136
Loa Loa (eye worm) thioredoxin reductase 0.0049 0.2533 0.2922
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0609 0.0641
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0667 0.0944
Leishmania major acetyl-CoA synthetase, putative 0.0007 0.0069 0.0119
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0261 0.0228
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.0645 0.1183
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0667 0.0944
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0261 0.0257
Mycobacterium ulcerans O-succinylbenzoic acid--CoA ligase 0.0007 0.0069 0.0592
Trichomonas vaginalis CAMK family protein kinase 0.0048 0.2501 0.3372
Loa Loa (eye worm) Smad1 0.0008 0.014 0.0085
Trypanosoma cruzi metallo-peptidase, Clan MH, Family M20 0.0074 0.4032 0.7441
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0609 0.0605
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0016 0.0609 0.1117
Trypanosoma cruzi Silent information regulator 2 related protein 1 0.0017 0.0648 0.1189
Echinococcus multilocularis geminin 0.0176 1 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0112 0.6236 0.8943
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0261 0.0228
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0261 0.0228
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0607 0.0639
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0261 0.0359
Echinococcus granulosus smad 0.0008 0.014 0.0136
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0017 0.0645 0.1183
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0609 0.0605
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0098 0.5417 0.6341
Brugia malayi MH1 domain containing protein 0.0008 0.014 0.0085
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.5417 0.7413
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0609 0.1117
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0017 0.0645 0.0641
Onchocerca volvulus Serine\/threonine kinase homolog 0.0098 0.5417 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.2439 0.2436
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.1092 0.1555
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0261 0.0257
Echinococcus granulosus NAD dependent deacetylase sirtuin 1 0.013 0.7283 0.7282
Entamoeba histolytica aspartyl aminopeptidase, putative 0.0074 0.4032 0.7441
Plasmodium falciparum M18 aspartyl aminopeptidase 0.0074 0.4032 1
Giardia lamblia Hypothetical protein 0.0017 0.0648 0.0889
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.014 0.0085
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0609 0.1117
Schistosoma mansoni chromatin regulatory protein sir2 0.013 0.7283 0.7282
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0044 0.2248 0.8873
Trichomonas vaginalis hypothetical protein 0.0035 0.17 0.2261
Loa Loa (eye worm) hypothetical protein 0.001 0.0261 0.0228
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0261 0.0228
Trichomonas vaginalis Clan MH, family M18, aspartyl aminopeptidase-like metallopeptidase 0.0074 0.4032 0.5493
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0609 0.2391
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0017 0.0648 0.0802
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0261 0.0257
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.2439 0.2436
Toxoplasma gondii propionate-CoA ligase 0.0007 0.0069 0.0255
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.1726 0.1965
Leishmania major 4-coumarate:coa ligase-like protein 0.0025 0.1092 0.201
Schistosoma mansoni hypothetical protein 0.0176 1 1
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.5417 0.7413
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0261 0.0257
Plasmodium falciparum glutathione reductase 0.0017 0.0645 0.159
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0007 0.0069 0.0064
Trypanosoma cruzi Silent information regulator 2 related protein 3 0.0017 0.0648 0.1189
Loa Loa (eye worm) hypothetical protein 0.0074 0.4032 0.4699
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0609 0.0605
Loa Loa (eye worm) aspartyl aminopeptidase 0.0074 0.4032 0.4699
Echinococcus granulosus GPCR family 2 0.0016 0.0607 0.0603
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0017 0.0645 0.5887
Trichomonas vaginalis glutathione reductase, putative 0.0017 0.0645 0.0798
Giardia lamblia NAD-dependent histone deacetylase Sir2 0.013 0.7283 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0261 0.0257
Echinococcus granulosus NAD dependent deacetylase sirtuin 7 0.0017 0.0648 0.0644
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0667 0.0944
Schistosoma mansoni chromatin regulatory protein sir2 0.0017 0.0648 0.0644
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0609 0.1117
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0261 0.0228
Mycobacterium ulcerans long-chain-acyl-CoA synthetase 0.0007 0.0069 0.0592
Mycobacterium ulcerans acyl-CoA synthetase 0.0007 0.0069 0.0592
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0017 0.0645 0.1183
Trypanosoma brucei trypanothione reductase 0.0049 0.2533 0.4673
Mycobacterium ulcerans non-ribosomal peptide synthetase MbtE 0.0007 0.0069 0.0592
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0261 0.0228
Loa Loa (eye worm) acetyltransferase 0.015 0.8502 1
Schistosoma mansoni thyroid hormone receptor 0.001 0.0261 0.0257

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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