Detailed information for compound 1362264

Basic information

Technical information
  • TDR Targets ID: 1362264
  • Name: 2-ethyl-N-(2-hydroxy-4-methylphenyl)butanamid e
  • MW: 221.295 | Formula: C13H19NO2
  • H donors: 2 H acceptors: 2 LogP: 2.86 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC(C(=O)Nc1ccc(cc1O)C)CC
  • InChi: 1S/C13H19NO2/c1-4-10(5-2)13(16)14-11-7-6-9(3)8-12(11)15/h6-8,10,15H,4-5H2,1-3H3,(H,14,16)
  • InChiKey: LEKIHWQKDIDBLE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-ethyl-N-(2-hydroxy-4-methyl-phenyl)butanamide
  • 2-ethyl-N-(2-hydroxy-4-methyl-phenyl)butyramide
  • AO-548/43196501
  • MLS000705735
  • SMR000231793
  • ZINC01017113

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Equus caballus Ferritin light chain Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0009 0.0015
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0056 0.1451 0.1451
Giardia lamblia Kinase, PLK 0.0101 0.284 0.5277
Plasmodium falciparum DNA repair protein REV1, putative 0.0018 0.0222 0.0413
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0012 0.0052 0.0052
Leishmania major DNA polymerase eta, putative 0.0045 0.1077 0.1693
Echinococcus granulosus chromobox protein 2 0.0012 0.0052 0.0052
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0009 0.0009
Brugia malayi nuclear hormone receptor 0.0011 0.0009 0.0015
Brugia malayi RNA recognition motif domain containing protein 0.0067 0.1795 0.3135
Trypanosoma brucei DNA polymerase IV, putative 0.0085 0.2343 0.4354
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0017 0.02 0.0371
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0052 0.0097
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0516 0.0958
Trypanosoma cruzi polo-like protein kinase, putative 0.0101 0.284 0.5277
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0009 0.0009
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0009 0.0009
Trypanosoma brucei DNA polymerase kappa, putative 0.0046 0.1115 0.2072
Entamoeba histolytica hypothetical protein 0.0038 0.0877 0.163
Schistosoma mansoni hypothetical protein 0.018 0.5356 0.5356
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0052 0.0097
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0009 0.0009
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0009 0.0015
Trypanosoma brucei DNA polymerase IV, putative 0.0085 0.2343 0.4354
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Loa Loa (eye worm) TAR-binding protein 0.0067 0.1795 0.1795
Loa Loa (eye worm) hypothetical protein 0.0011 0.0009 0.0009
Brugia malayi Isocitrate dehydrogenase 0.0017 0.02 0.0349
Giardia lamblia DNA damage repair protein 0.0018 0.0222 0.0413
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0009 0.0015
Trichomonas vaginalis importin beta-1, putative 0.0025 0.0454 0.0844
Brugia malayi Type III restriction enzyme, res subunit family protein 0.0012 0.0052 0.0091
Trypanosoma cruzi hypothetical protein, conserved 0.0018 0.0222 0.0413
Echinococcus granulosus phosphoglycerate kinase 1 0.0181 0.5381 0.5381
Loa Loa (eye worm) hypothetical protein 0.0011 0.0009 0.0009
Schistosoma mansoni hypothetical protein 0.0328 1 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0027 0.0516 0.0958
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0012 0.0052 0.0052
Toxoplasma gondii HEAT repeat-containing protein 0.0031 0.0637 0.1184
Wolbachia endosymbiont of Brugia malayi phosphoglycerate kinase 0.0181 0.5381 1
Plasmodium falciparum importin beta, putative 0.0031 0.0637 0.1184
Brugia malayi Valyl-tRNA synthetase 0.0012 0.0052 0.0091
Onchocerca volvulus 0.0012 0.0052 0.0091
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.0877 0.0877
Plasmodium vivax importin-beta 2, putative 0.0031 0.0637 0.1184
Trypanosoma brucei DNA polymerase kappa, putative 0.0063 0.1672 0.3107
Leishmania major importin beta-1 subunit, putative 0.0025 0.0454 0.0491
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0181 0.5381 1
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0012 0.0052 0.0097
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0009 0.0009
Toxoplasma gondii 'chromo' (CHRromatin Organization MOdifier) domain-containing protein 0.0012 0.0052 0.0097
Loa Loa (eye worm) hypothetical protein 0.0011 0.0009 0.0009
Toxoplasma gondii chromodomain helicase DNA binding protein CHD1/SWI2/SNF2 0.0012 0.0052 0.0097
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.284 0.5277
Brugia malayi RNA, U transporter 1 0.0087 0.2421 0.4227
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0009 0.0009
Mycobacterium tuberculosis Conserved hypothetical protein 0.0056 0.1451 0.2414
Trypanosoma brucei DNA damage repair protein, putative 0.0018 0.0222 0.0413
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0012 0.0049 0.0049
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Loa Loa (eye worm) hypothetical protein 0.0012 0.0052 0.0052
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0013 0.0089 0.0089
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0052 0.0097
Toxoplasma gondii LsmAD domain-containing protein 0.0027 0.0516 0.0958
Schistosoma mansoni hypothetical protein 0.018 0.5356 0.5356
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.0877 0.0877
Trypanosoma brucei phosphoglycerate kinase 0.0181 0.5381 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0052 0.0097
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0181 0.5381 1
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0017 0.02 0.02
Leishmania major DNA polymerase kappa, putative 0.0063 0.1672 0.2841
Echinococcus multilocularis GPCR, family 2 0.0034 0.0728 0.0728
Trypanosoma cruzi importin beta-1 subunit, putative 0.0025 0.0454 0.0844
Schistosoma mansoni DNA polymerase eta 0.0084 0.2306 0.2306
Trypanosoma cruzi DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0025 0.0444 0.0825
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0066 0.1766 0.3282
Trypanosoma brucei unspecified product 0.0039 0.0898 0.1669
Brugia malayi Heterochromatin protein 1 0.0074 0.2008 0.3505
Schistosoma mansoni importin beta-1 0.0031 0.0637 0.0637
Trypanosoma brucei polo-like protein kinase 0.0101 0.284 0.5277
Trypanosoma brucei DNA polymerase eta, putative 0.0084 0.2306 0.4284
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0009 0.0009
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0017 0.02 0.02
Schistosoma mansoni hypothetical protein 0.0012 0.0049 0.0049
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.098 0.1822
Loa Loa (eye worm) transcription factor SMAD2 0.0127 0.3676 0.3676
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0066 0.1766 0.3282
Brugia malayi Importin beta-1 subunit 0.0031 0.0637 0.1113
Brugia malayi Phosphoglycerate kinase 0.0066 0.1766 0.3083
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.02 0.0371
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0052 0.0097
Brugia malayi chromobox protein homolog 3 0.0042 0.098 0.1711
Echinococcus multilocularis importin subunit beta 1 0.0031 0.0637 0.0637
Schistosoma mansoni SET domain protein 0.0011 0.0026 0.0026
Schistosoma mansoni chromobox protein 0.0012 0.0052 0.0052
Brugia malayi Protein cec-1. 0.0012 0.0052 0.0091
Trichomonas vaginalis CAMK family protein kinase 0.005 0.1239 0.2302
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.02 0.0371
Echinococcus multilocularis dna polymerase kappa 0.0085 0.2343 0.2343
Plasmodium falciparum phosphoglycerate kinase 0.0181 0.5381 1
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0045 0.1077 0.2002
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0101 0.284 0.284
Echinococcus multilocularis chromobox protein 1 0.0074 0.2008 0.2008
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Plasmodium vivax phosphoglycerate kinase, putative 0.0181 0.5381 1
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0009 0.0009
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0101 0.284 0.284
Schistosoma mansoni phosphoglycerate kinase 0.0181 0.5381 0.5381
Trypanosoma cruzi PAB1-binding protein , putative 0.0027 0.0516 0.0958
Trypanosoma brucei unspecified product 0.0078 0.2122 0.3943
Echinococcus multilocularis chromodomain helicase DNA binding protein 1 0.0012 0.0052 0.0052
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0009 0.0009
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0052 0.0097
Loa Loa (eye worm) helicase 0.0012 0.0052 0.0052
Brugia malayi serine/threonine-protein kinase plk-2 0.0101 0.284 0.4957
Trichomonas vaginalis chromobox protein, putative 0.0074 0.2008 0.3731
Entamoeba histolytica hypothetical protein 0.0025 0.0454 0.0844
Toxoplasma gondii 'chromo' (CHRromatin Organization MOdifier) domain-containing protein 0.0012 0.0052 0.0097
Loa Loa (eye worm) hypothetical protein 0.0027 0.0516 0.0516
Brugia malayi hypothetical protein 0.0017 0.0216 0.0377
Loa Loa (eye worm) hypothetical protein 0.0192 0.5728 0.5728
Schistosoma mansoni phosphoglycerate kinase 0.0181 0.5381 0.5381
Plasmodium vivax hypothetical protein, conserved 0.0012 0.0052 0.0097
Echinococcus granulosus chromodomain helicase DNA binding protein 1 0.0012 0.0052 0.0052
Loa Loa (eye worm) RNA binding protein 0.0067 0.1795 0.1795
Brugia malayi Latrophilin receptor protein 2 0.0034 0.0728 0.1271
Leishmania major DNA polymerase kappa, putative 0.0018 0.0222 0.0044
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0056 0.1451 0.1451
Trypanosoma brucei phosphoglycerate kinase 0.0066 0.1766 0.3282
Trypanosoma cruzi DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Brugia malayi nuclear receptor NHR-88 0.0011 0.0009 0.0015
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0181 0.5381 1
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0009 0.0009
Mycobacterium ulcerans hypothetical protein 0.0018 0.0222 0.0413
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0009 0.0009
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0052 0.0097
Loa Loa (eye worm) hypothetical protein 0.0011 0.0009 0.0009
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0009 0.0009
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Entamoeba histolytica hypothetical protein 0.0012 0.0052 0.0097
Entamoeba histolytica hypothetical protein 0.0012 0.0052 0.0097
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.02 0.02
Brugia malayi steroid hormone receptor 0.0011 0.0009 0.0015
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0009 0.0015
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.02 0.0371
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0009 0.0015
Trichomonas vaginalis hypothetical protein 0.0012 0.0052 0.0097
Trypanosoma cruzi DNA polymerase eta, putative 0.0084 0.2306 0.4284
Schistosoma mansoni chromobox protein 0.0074 0.2008 0.2008
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0052 0.0097
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.284 0.5277
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Schistosoma mansoni tar DNA-binding protein 0.0067 0.1795 0.1795
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Echinococcus granulosus tar DNA binding protein 0.0067 0.1795 0.1795
Schistosoma mansoni hypothetical protein 0.0034 0.0728 0.0728
Trypanosoma brucei DNA damage repair protein, putative 0.0018 0.0222 0.0413
Schistosoma mansoni hypothetical protein 0.0073 0.1957 0.1957
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0012 0.0049 0.0049
Schistosoma mansoni chromobox protein 0.0012 0.0052 0.0052
Schistosoma mansoni DNA polymerase IV / kappa 0.0018 0.0222 0.0222
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0085 0.2343 0.4354
Treponema pallidum phosphoglycerate kinase 0.0181 0.5381 1
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0017 0.02 0.02
Trichomonas vaginalis chromobox protein, putative 0.0045 0.108 0.2007
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0009 0.0009
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0009 0.0009
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0009 0.0009
Entamoeba histolytica hypothetical protein 0.0038 0.0877 0.163
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Brugia malayi Associated with TFs and helicases family protein 0.0012 0.0052 0.0091
Leishmania major DNA polymerase eta, putative 0.0084 0.2306 0.4064
Trichomonas vaginalis conserved hypothetical protein 0.0042 0.098 0.1822
Schistosoma mansoni hypothetical protein 0.0034 0.0728 0.0728
Brugia malayi N-terminal motif family protein 0.0192 0.5728 1
Brugia malayi CHD4 protein 0.0012 0.0052 0.0091
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0009 0.0009
Echinococcus multilocularis dna polymerase eta 0.0084 0.2306 0.2306
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0009 0.0015
Echinococcus multilocularis histone lysine N methyltransferase, H3 lysine 36 0.0011 0.0026 0.0026
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0034 0.0728 0.0728
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0009 0.0009
Trypanosoma brucei PAB1-binding protein , putative 0.0027 0.0516 0.0958
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.284 0.5277
Schistosoma mansoni chromobox protein-related (chromobox 1) (heterochromatin 1) 0.0012 0.0052 0.0052
Leishmania major DNA damage repair protein, putative 0.0018 0.0222 0.0044
Loa Loa (eye worm) heterochromatin protein 1 0.0074 0.2008 0.2008
Loa Loa (eye worm) hypothetical protein 0.0011 0.0009 0.0009
Trichomonas vaginalis DNA polymerase eta, putative 0.0085 0.2343 0.4354
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0052 0.0097
Loa Loa (eye worm) isocitrate dehydrogenase 0.0017 0.02 0.02
Brugia malayi MH2 domain containing protein 0.0127 0.3676 0.6418
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0454 0.0844
Echinococcus granulosus histone lysine N methyltransferase H3 lysine 36 0.0011 0.0026 0.0026
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0034 0.0728 0.0728
Entamoeba histolytica hypothetical protein 0.0012 0.0052 0.0097
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0009 0.0009
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0052 0.0097
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Trypanosoma brucei DNA polymerase kappa, putative 0.0046 0.1119 0.208
Brugia malayi SET domain containing protein 0.0013 0.0089 0.0156
Echinococcus multilocularis histone lysine N methyltransferase NSD3 0.0035 0.0769 0.0769
Entamoeba histolytica hypothetical protein 0.0038 0.0877 0.163
Echinococcus multilocularis Chromobox protein 3 0.0012 0.0052 0.0052
Chlamydia trachomatis phosphoglycerate kinase 0.0181 0.5381 1
Echinococcus granulosus dna polymerase eta 0.0084 0.2306 0.2306
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0598 0.111
Loa Loa (eye worm) hypothetical protein 0.0073 0.1957 0.1957
Trypanosoma brucei chrX additional, unordered contigs 0.0018 0.0222 0.0413
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0009 0.0015
Brugia malayi ImpB/MucB/SamB family protein 0.0084 0.2306 0.4025
Echinococcus multilocularis phosphoglycerate kinase 1 0.0181 0.5381 0.5381
Schistosoma mansoni coup transcription factor 0.0011 0.0009 0.0009
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0042 0.098 0.1711
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.02 0.02
Plasmodium falciparum chromodomain-helicase-DNA-binding protein 1 homolog, putative 0.0012 0.0052 0.0097
Schistosoma mansoni tar DNA-binding protein 0.0067 0.1795 0.1795
Trypanosoma brucei unspecified product 0.0039 0.0898 0.1669
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0012 0.0052 0.0052
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0009 0.0015
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0017 0.02 0.0371
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0012 0.0052 0.0052
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0009 0.0009
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0045 0.108 0.1885
Brugia malayi TAR-binding protein 0.0067 0.1795 0.3135
Onchocerca volvulus 0.0013 0.0089 0.0156
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0009 0.0009
Mycobacterium ulcerans DNA polymerase IV 0.0085 0.2343 0.4354
Loa Loa (eye worm) hypothetical protein 0.0084 0.2306 0.2306
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0052 0.0097
Schistosoma mansoni hypothetical protein 0.0034 0.0728 0.0728
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0067 0.1795 0.1795
Loa Loa (eye worm) MH2 domain-containing protein 0.0127 0.3676 0.3676
Loa Loa (eye worm) hypothetical protein 0.0011 0.0009 0.0009
Schistosoma mansoni serine/threonine protein kinase 0.0101 0.284 0.284
Mycobacterium leprae Probable phosphoglycerate kinase Pgk 0.0181 0.5381 1
Plasmodium vivax hypothetical protein, conserved 0.0012 0.0052 0.0097
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0052 0.0097
Leishmania major hypothetical protein, conserved 0.0027 0.0516 0.0609
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0009 0.0009
Schistosoma mansoni chromobox protein 0.0074 0.2008 0.2008
Entamoeba histolytica phosphoglycerate kinase, putative 0.0181 0.5381 1
Echinococcus granulosus Chromobox protein 3 0.0012 0.0052 0.0052
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0009 0.0009
Brugia malayi hypothetical protein 0.0027 0.0516 0.09
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0009 0.0015
Trypanosoma cruzi DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0009 0.0015
Schistosoma mansoni tar DNA-binding protein 0.0067 0.1795 0.1795
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0063 0.1672 0.2841
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0009 0.0015
Loa Loa (eye worm) latrophilin receptor protein 2 0.0034 0.0728 0.0728
Trypanosoma brucei phosphoglycerate kinase 0.0181 0.5381 1
Mycobacterium ulcerans phosphoglycerate kinase 0.0181 0.5381 1
Mycobacterium tuberculosis Probable phosphoglycerate kinase Pgk 0.0181 0.5381 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0009 0.0009
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0009 0.0009
Toxoplasma gondii phosphoglycerate kinase PGKI 0.0181 0.5381 1
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.02 0.0371
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0009 0.0009
Brugia malayi polk-prov protein 0.0046 0.1115 0.1946
Echinococcus granulosus chromobox protein 1 0.0074 0.2008 0.2008
Trichomonas vaginalis phosphoglycerate kinase, putative 0.0181 0.5381 1
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0009 0.0015
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0009 0.0009
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0052 0.0097
Echinococcus multilocularis isocitrate dehydrogenase 0.0017 0.02 0.02
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0009 0.0009
Trichomonas vaginalis CAMK family protein kinase 0.005 0.1239 0.2302
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0101 0.284 0.284
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0052 0.0097
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0516 0.0958
Echinococcus granulosus Chromo domain 0.0012 0.0052 0.0052
Trypanosoma brucei DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Trypanosoma cruzi PAS-domain containing phosphoglycerate kinase, putative 0.0066 0.1766 0.3282
Trypanosoma brucei DNA polymerase IV, putative 0.0078 0.2122 0.3943
Brugia malayi M-phase phosphoprotein, mpp8 0.0012 0.0052 0.0091
Echinococcus granulosus chromobox protein 1 0.0074 0.2008 0.2008
Trypanosoma cruzi DNA polymerase kappa, putative 0.0085 0.2343 0.4354
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0192 0.5728 1
Echinococcus multilocularis chromobox protein 1 0.0074 0.2008 0.2008
Schistosoma mansoni hypothetical protein 0.0012 0.0052 0.0052
Trichomonas vaginalis chromobox protein, putative 0.0074 0.2008 0.3731
Entamoeba histolytica chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0052 0.0097
Loa Loa (eye worm) hypothetical protein 0.0031 0.0637 0.0637
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0012 0.0052 0.0097
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0009 0.0009
Schistosoma mansoni tar DNA-binding protein 0.0067 0.1795 0.1795
Loa Loa (eye worm) hypothetical protein 0.0106 0.3016 0.3016
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0328 1 1
Echinococcus granulosus dna polymerase kappa 0.0085 0.2343 0.2343
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0017 0.02 0.0371
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.02 0.02
Onchocerca volvulus Serine\/threonine kinase homolog 0.0101 0.284 0.4957
Mycobacterium ulcerans DNA polymerase IV 0.0085 0.2343 0.4354
Leishmania major PAS-domain containing phosphoglycerate kinase, putative 0.0066 0.1766 0.3023
Trypanosoma cruzi DNA damage repair protein, putative 0.0018 0.0222 0.0413
Loa Loa (eye worm) hypothetical protein 0.0011 0.0009 0.0009
Trypanosoma cruzi DNA damage repair protein, putative 0.0018 0.0222 0.0413
Echinococcus granulosus GPCR family 2 0.0034 0.0728 0.0728
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0056 0.1451 0.1451
Trypanosoma brucei DNA polymerase kappa, putative 0.0046 0.1115 0.2072
Giardia lamblia DINP protein human, muc B family 0.0063 0.1672 0.3107
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0012 0.0052 0.0052
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0034 0.0728 0.0728
Echinococcus granulosus geminin 0.018 0.5356 0.5356
Loa Loa (eye worm) hypothetical protein 0.0046 0.1115 0.1115
Trypanosoma cruzi polo-like protein kinase, putative 0.0101 0.284 0.5277
Schistosoma mansoni tar DNA-binding protein 0.0067 0.1795 0.1795
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0009 0.0009
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.284 0.5277
Trypanosoma brucei hypothetical protein, conserved 0.0018 0.0222 0.0413
Brugia malayi isocitrate dehydrogenase 0.0017 0.02 0.0349
Loa Loa (eye worm) hypothetical protein 0.0012 0.0052 0.0052
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0009 0.0015
Loa Loa (eye worm) hypothetical protein 0.0181 0.5381 0.5381
Schistosoma mansoni SET domain protein 0.0035 0.0769 0.0769
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0106 0.3016 0.3016
Plasmodium vivax ataxin-2 like protein, putative 0.0027 0.0516 0.0958
Trichomonas vaginalis Heterochromatin protein, putative 0.0012 0.0052 0.0097
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0009 0.0009
Plasmodium vivax DNA repair protein REV1, putative 0.0018 0.0222 0.0413
Trichomonas vaginalis chromobox protein, putative 0.0045 0.108 0.2007
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0025 0.0454 0.0844
Schistosoma mansoni terminal deoxycytidyl transferase 0.0056 0.1451 0.1451
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0063 0.1672 0.2841
Trypanosoma cruzi DNA polymerase eta, putative 0.0045 0.1077 0.2002
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0009 0.0009
Schistosoma mansoni kinase 0.0051 0.1281 0.1281
Entamoeba histolytica serine/threonine protein kinase, putative 0.0101 0.284 0.5277
Echinococcus granulosus histone lysine N methyltransferase NSD3 0.0035 0.0769 0.0769
Leishmania major phosphoglycerate kinase C, glycosomal 0.0181 0.5381 1
Brugia malayi hypothetical protein 0.0012 0.0052 0.0091
Brugia malayi Phosphoglycerate kinase 0.0181 0.5381 0.9395
Loa Loa (eye worm) hypothetical protein 0.0012 0.0052 0.0052
Echinococcus multilocularis snurportin 1 0.0328 1 1
Echinococcus multilocularis chromobox protein 2 0.0012 0.0052 0.0052
Brugia malayi hypothetical protein 0.0038 0.0877 0.1531
Loa Loa (eye worm) hypothetical protein 0.0034 0.0728 0.0728
Trypanosoma cruzi 3-phosphoglycerate kinase, glycosomal 0.0066 0.1766 0.3282
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Brugia malayi ecdysteroid receptor 0.0011 0.0009 0.0015
Brugia malayi latrophilin 2 splice variant baaae 0.0073 0.1957 0.3416
Giardia lamblia Phosphoglycerate kinase 0.0181 0.5381 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0052 0.0097
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0106 0.3016 0.5265
Brugia malayi RNA binding protein 0.0067 0.1795 0.3135
Brugia malayi Calcitonin receptor-like protein seb-1 0.0106 0.3016 0.5265
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0011 0.0009 0.0009
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0009 0.0015
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0009 0.0015
Onchocerca volvulus 0.0033 0.0697 0.1217
Trypanosoma brucei DNA polymerase kappa, putative 0.0046 0.1119 0.208
Loa Loa (eye worm) hypothetical protein 0.0012 0.0052 0.0052
Leishmania major phosphoglycerate kinase B, cytosolic 0.0181 0.5381 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0009 0.0009
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0056 0.1451 0.1451
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.284 0.5277
Onchocerca volvulus 0.0011 0.0009 0.0015
Schistosoma mansoni hypothetical protein 0.0034 0.0728 0.0728
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.284 0.5277
Trypanosoma cruzi phosphoglycerate kinase, putative 0.0066 0.1766 0.3282
Loa Loa (eye worm) hypothetical protein 0.0042 0.098 0.098
Trypanosoma brucei DNA polymerase kappa, putative 0.0046 0.1119 0.208
Schistosoma mansoni hypothetical protein 0.0038 0.0877 0.0877
Loa Loa (eye worm) hypothetical protein 0.0033 0.0697 0.0697
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0009 0.0015
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0012 0.0052 0.0097
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0034 0.0728 0.0728
Trichomonas vaginalis CAMK family protein kinase 0.0101 0.284 0.5277
Brugia malayi ImpB/MucB/SamB family protein 0.0056 0.1451 0.2533
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0009 0.0015
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0101 0.284 0.5095
Trypanosoma cruzi hypothetical protein, conserved 0.0018 0.0222 0.0413
Echinococcus multilocularis Chromo domain 0.0012 0.0052 0.0052
Plasmodium falciparum heterochromatin protein 1 0.0012 0.0052 0.0097
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0009 0.0009
Echinococcus multilocularis geminin 0.018 0.5356 0.5356
Entamoeba histolytica deoxycytidyl transferase, putative 0.0056 0.1451 0.2696
Trichomonas vaginalis chromobox protein, putative 0.0012 0.0052 0.0097
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0017 0.02 0.0371
Trypanosoma brucei importin beta-1 subunit, putative 0.0031 0.0637 0.1184
Loa Loa (eye worm) CHromoDomain protein family member 0.0012 0.0052 0.0052
Onchocerca volvulus 0.0012 0.0052 0.0091
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.0598 0.111
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0034 0.0728 0.1271
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.0877 0.0877
Echinococcus granulosus importin subunit beta 1 0.0031 0.0637 0.0637
Trypanosoma brucei importin beta-1 subunit, putative 0.0031 0.0637 0.1184
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0009 0.0009
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0009 0.0009
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0009 0.0015
Toxoplasma gondii phosphoglycerate kinase PGKII 0.0181 0.5381 1
Plasmodium vivax heterochromatin protein 1, putative 0.0012 0.0052 0.0097
Loa Loa (eye worm) hypothetical protein 0.0012 0.0052 0.0052
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0009 0.0009
Trypanosoma brucei phosphoglycerate kinase, putative 0.0066 0.1766 0.3282
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0009 0.0015
Trypanosoma brucei hypothetical protein, conserved 0.0018 0.0222 0.0413
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0009 0.0009
Entamoeba histolytica hypothetical protein 0.0038 0.0877 0.163
Loa Loa (eye worm) hypothetical protein 0.0012 0.0052 0.0052
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0018 0.0222 0.0413
Trichomonas vaginalis conserved hypothetical protein 0.0012 0.0052 0.0097
Echinococcus multilocularis tar DNA binding protein 0.0067 0.1795 0.1795
Loa Loa (eye worm) hypothetical protein 0.0012 0.0052 0.0052

Activities

Activity type Activity value Assay description Source Reference
Potency (binding) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

No literature references available for this target.

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