Detailed information for compound 1589153

Basic information

Technical information
  • TDR Targets ID: 1589153
  • Name: (3E,5E)-3,5-bis[(4-dimethylaminophenyl)methyl idene]-1,1-dimethylpiperidin-1-ium-4-one iodi de
  • MW: 517.446 | Formula: C25H32IN3O
  • H donors: 0 H acceptors: 1 LogP: 4.76 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 2
  • SMILES: CN(c1ccc(cc1)/C=C/1\C[N+](C)(C)C/C(=C\c2ccc(cc2)N(C)C)/C1=O)C.[I-]
  • InChi: 1S/C25H32N3O.HI/c1-26(2)23-11-7-19(8-12-23)15-21-17-28(5,6)18-22(25(21)29)16-20-9-13-24(14-10-20)27(3)4;/h7-16H,17-18H2,1-6H3;1H/q+1;/p-1/b21-15+,22-16+;
  • InChiKey: JVOYGKMQZMEFBW-HYOXNGFTSA-M  


Substructure search Similarity search

Network

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Synonyms

  • (3E,5E)-3,5-bis[(4-dimethylaminophenyl)methylene]-1,1-dimethyl-piperidin-1-ium-4-one iodide
  • (3E,5E)-3,5-bis[(4-dimethylaminophenyl)methylene]-1,1-dimethyl-4-piperidin-1-iumone iodide
  • (3E,5E)-3,5-bis(4-dimethylaminobenzylidene)-1,1-dimethyl-piperidin-1-ium-4-one iodide
  • (3E,5E)-3,5-bis[(4-dimethylaminophenyl)methylidene]-1,1-dimethyl-piperidin-1-ium-4-one iodide
  • 122864-73-7
  • (E,E)-Piperidinium, 3,5-bis{[4-(dimethylamino)phenyl]methylene}-1,1-dimethyl-4-oxo, iodide
  • NSC618757
  • Piperidinium, 3,5-bis[4-[(dimethylamino)phenyl]methylene]-1,1- dimethyl-4-oxo-, iodide

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
Schistosoma mansoni phd finger protein 0.0011 0.0134 0.0134
Loa Loa (eye worm) TAR-binding protein 0.0076 0.1915 0.1915
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0019 0.0342 0.0342
Trichomonas vaginalis DNA helicase recq, putative 0.0029 0.0614 0.2084
Brugia malayi hypothetical protein 0.002 0.0358 0.0365
Brugia malayi Ets-domain containing protein 0.0087 0.2215 0.2256
Loa Loa (eye worm) hypothetical protein 0.0012 0.014 0.014
Onchocerca volvulus 0.0365 0.9815 1
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0019 0.0342 0.4425
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0012 0.014 0.0475
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.0012 0.014 0.014
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0012 0.014 0.0475
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0012 0.014 0.0475
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0012 0.014 0.014
Trypanosoma brucei transcription elongation factor s-II, putative 0.0011 0.0134 0.0456
Echinococcus granulosus multidrug resistance protein 1 0.0012 0.014 0.014
Echinococcus multilocularis histone lysine N methyltransferase, H3 lysine 36 0.0013 0.0171 0.0171
Leishmania major ATP-binding cassette protein subfamily B, member 2, putative 0.0012 0.014 0.0475
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0114 0.2944 1
Schistosoma mansoni multidrug resistance protein 0.0012 0.014 0.014
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0653 0.2219
Brugia malayi Fli-1 protein 0.0265 0.7091 0.7225
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1332 0.1332
Schistosoma mansoni ran 0.0026 0.0521 0.0521
Schistosoma mansoni DNA helicase recq5 0.0012 0.0147 0.0147
Loa Loa (eye worm) hypothetical protein 0.0075 0.1867 0.1867
Echinococcus multilocularis PWWP domain containing protein 2A 0.0011 0.0134 0.0134
Echinococcus granulosus ewsr:fli fusion protein type 0.0013 0.0167 0.0167
Trichomonas vaginalis ABC transporter, putative 0.0012 0.014 0.0475
Brugia malayi hypothetical protein 0.0011 0.0134 0.0137
Echinococcus granulosus ETS transcription factor Elf 2 0.0013 0.0167 0.0167
Leishmania major hypothetical protein, conserved 0.003 0.0653 0.2219
Brugia malayi RNA, U transporter 1 0.0099 0.2531 0.2579
Brugia malayi serine/threonine-protein kinase plk-2 0.0114 0.2944 0.2999
Schistosoma mansoni hypothetical protein 0.0011 0.0134 0.0134
Entamoeba histolytica hypothetical protein 0.0028 0.0593 0.2014
Loa Loa (eye worm) DNA-binding protein D-ETS-3 0.0013 0.0167 0.0167
Trichomonas vaginalis CAMK family protein kinase 0.0056 0.1366 0.4641
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0012 0.014 0.0475
Schistosoma mansoni hepatoma derived growth factor 0.0011 0.0134 0.0134
Echinococcus multilocularis tar DNA binding protein 0.0076 0.1915 0.1915
Entamoeba histolytica P-glycoprotein-2 0.0012 0.014 0.0475
Plasmodium falciparum importin beta, putative 0.0035 0.0773 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0167 0.0167
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0012 0.0147 0.0147
Loa Loa (eye worm) fli-1 protein 0.0265 0.7091 0.7091
Echinococcus granulosus importin subunit beta 1 0.0035 0.0773 0.0773
Loa Loa (eye worm) hypothetical protein 0.0012 0.0136 0.0136
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.2944 1
Brugia malayi Importin beta-1 subunit 0.0035 0.0773 0.0788
Onchocerca volvulus Serine\/threonine kinase homolog 0.0114 0.2944 0.2902
Echinococcus granulosus ETS transcription factor Elf 1 0.0013 0.0167 0.0167
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0244 0.0389
Trichomonas vaginalis ABC transporter, putative 0.0012 0.014 0.0475
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0026 0.0521 0.1338
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.1915 0.1951
Schistosoma mansoni DNA helicase recq1 0.0012 0.0147 0.0147
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0012 0.014 0.0475
Loa Loa (eye worm) hypothetical protein 0.0146 0.3816 0.3816
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0342 0.1162
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0012 0.014 0.0475
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0114 0.2944 0.2944
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1332 0.1332
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0653 0.8448
Schistosoma mansoni hypothetical protein 0.0013 0.0167 0.0167
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0012 0.014 0.014
Echinococcus granulosus PWWP domain containing protein 2A 0.0011 0.0134 0.0134
Brugia malayi Bloom's syndrome protein homolog 0.0029 0.0614 0.0625
Toxoplasma gondii ATP-binding cassette transporter ABC.B1 0.0012 0.014 0.181
Echinococcus multilocularis PWWP domain containing protein 2A 0.0011 0.0134 0.0134
Trypanosoma cruzi importin beta-1 subunit, putative 0.0028 0.0593 0.1632
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0012 0.014 0.0475
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.1332 0.1332
Echinococcus granulosus ETS transcription factor Elf 5 0.0013 0.0167 0.0167
Trichomonas vaginalis importin beta-1, putative 0.0028 0.0593 0.2014
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0087 0.2215 0.2215
Loa Loa (eye worm) hypothetical protein 0.0011 0.0134 0.0134
Schistosoma mansoni hypothetical protein 0.0011 0.0134 0.0134
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0012 0.014 0.0475
Plasmodium falciparum multidrug resistance protein 1 0.0012 0.014 0.181
Brugia malayi DNA-binding protein D-ETS-3 0.0013 0.0167 0.017
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0653 0.8448
Toxoplasma gondii ABC transporter transmembrane region domain-containing protein 0.0012 0.014 0.181
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0342 0.0342
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0012 0.014 0.014
Entamoeba histolytica P-glycoprotein-2 0.0012 0.014 0.0475
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0244 0.0828
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0008 0.0043 0.0147
Giardia lamblia Kinase, PLK 0.0114 0.2944 1
Plasmodium vivax multidrug resistance protein 1, putative 0.0012 0.014 0.181
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0025 0.0517 0.6688
Schistosoma mansoni multidrug resistance protein 0.0012 0.014 0.014
Leishmania major hypothetical protein, conserved 0.0011 0.0134 0.0456
Echinococcus multilocularis snurportin 1 0.0372 1 1
Trichomonas vaginalis ABC transporter, putative 0.0012 0.014 0.0475
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0019 0.0342 0.074
Trypanosoma brucei ULK family serine/threonine-protein kinase, putative 0.0007 0.001 0.0035
Schistosoma mansoni kinase 0.0058 0.1407 0.1407
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.1332 0.1332
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0147 0.1906
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0012 0.014 0.0475
Entamoeba histolytica recQ family helicase, putative 0.0015 0.0244 0.0828
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0653 0.8448
Echinococcus granulosus PWWP domain containing protein 2A 0.0011 0.0134 0.0134
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.2944 1
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0026 0.0521 0.6744
Echinococcus granulosus ETS transcription factor Elf 2 0.0013 0.0167 0.0167
Loa Loa (eye worm) hypothetical protein 0.0013 0.0167 0.0167
Entamoeba histolytica P-glycoprotein-2, putative 0.0012 0.014 0.0475
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0012 0.014 0.0475
Trichomonas vaginalis CAMK family protein kinase 0.0056 0.1366 0.4641
Echinococcus multilocularis ETS transcription factor Elf 2 0.0013 0.0167 0.0167
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0012 0.014 0.014
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0014 0.0194 0.0194
Brugia malayi TAR-binding protein 0.0076 0.1915 0.1951
Onchocerca volvulus 0.0012 0.014 0.0006
Echinococcus multilocularis multidrug resistance protein 1 0.0012 0.014 0.014
Echinococcus granulosus GTP binding nuclear protein Ran 0.0026 0.0521 0.0521
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.2944 1
Schistosoma mansoni hypothetical protein 0.0011 0.0134 0.0134
Trichomonas vaginalis DNA helicase recq1, putative 0.0029 0.0614 0.2084
Echinococcus multilocularis histone lysine N methyltransferase NSD3 0.004 0.0903 0.0903
Trypanosoma brucei polo-like protein kinase 0.0114 0.2944 1
Echinococcus granulosus histone lysine N methyltransferase NSD3 0.004 0.0903 0.0903
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1915 0.1915
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0012 0.014 0.0475
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0012 0.0147 0.0147
Echinococcus multilocularis multidrug resistance protein 1 0.0008 0.0043 0.0043
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.035 0.4528
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0773 1
Echinococcus multilocularis ETS transcription factor Elf 5 0.0013 0.0167 0.0167
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.2944 1
Loa Loa (eye worm) multidrug resistance protein 3 0.0012 0.014 0.014
Echinococcus multilocularis peregrin 0.0011 0.0134 0.0134
Schistosoma mansoni importin beta-1 0.0035 0.0773 0.0773
Trichomonas vaginalis ABC transporter, putative 0.0012 0.014 0.0475
Brugia malayi hypothetical protein 0.003 0.0653 0.0666
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0.0342 0.4425
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0773 0.2627
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0013 0.0167 0.0167
Brugia malayi Ets-domain containing protein 0.0087 0.2215 0.2256
Echinococcus granulosus multidrug resistance protein 1 0.0008 0.0043 0.0043
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1332 0.1332
Echinococcus multilocularis ETS transcription factor Elf 1 0.0013 0.0167 0.0167
Schistosoma mansoni hepatoma derived growth factor 0.0011 0.0134 0.0134
Entamoeba histolytica P-glyco protein 6, putative 0.0012 0.014 0.0475
Entamoeba histolytica P-glycoprotein-5 0.0012 0.014 0.0475
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0012 0.014 0.0475
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0012 0.014 0.014
Echinococcus multilocularis geminin 0.0205 0.5424 0.5424
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1915 0.1915
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0012 0.014 0.0475
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.002 0.0356 0.461
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0026 0.0521 0.1378
Trichomonas vaginalis ran, putative 0.0026 0.0521 0.1772
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0026 0.0521 0.1378
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0019 0.0342 0.1162
Entamoeba histolytica P-glycoprotein-1 0.0012 0.014 0.0475
Brugia malayi transcription factor E74 isoform 0.0013 0.0167 0.017
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1915 0.1915
Echinococcus multilocularis ets variant gene 4 0.0013 0.0167 0.0167
Brugia malayi ABC transporter family protein 0.0012 0.014 0.0143
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0012 0.014 0.0475
Echinococcus multilocularis bloom syndrome protein 0.0029 0.0614 0.0614
Trichomonas vaginalis abcb9, putative 0.0012 0.014 0.0475
Echinococcus granulosus multidrug resistance protein 1 0.0012 0.014 0.014
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0653 0.1847
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0773 0.2627
Loa Loa (eye worm) ets-domain-containing protein 0.0013 0.0167 0.0167
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0019 0.0342 0.0342
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.2944 1
Echinococcus granulosus tar DNA binding protein 0.0076 0.1915 0.1915
Schistosoma mansoni gabp alpha 0.0087 0.2215 0.2215
Brugia malayi Isocitrate dehydrogenase 0.0019 0.0342 0.0349
Echinococcus granulosus 5'partial|ATP binding cassette sub family B 0.0012 0.0136 0.0136
Schistosoma mansoni smdr2 0.0012 0.014 0.014
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.2944 1
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0026 0.0521 0.6744
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0114 0.2944 0.2944
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0773 0.0773
Brugia malayi isocitrate dehydrogenase 0.0019 0.0342 0.0349
Echinococcus multilocularis multidrug resistance protein 1 0.0012 0.014 0.014
Loa Loa (eye worm) D-ets-2 protein 0.0013 0.0167 0.0167
Schistosoma mansoni multidrug resistance protein 0.0012 0.014 0.014
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0244 0.0828
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0026 0.0521 0.1772
Echinococcus granulosus GA binding protein alpha chain 0.0087 0.2215 0.2215
Chlamydia trachomatis ABC transporter ATP binding protein/permease 0.0012 0.014 0.5
Schistosoma mansoni hypothetical protein 0.0205 0.5424 0.5424
Schistosoma mansoni hypothetical protein 0.0014 0.0194 0.0194
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0342 0.1162
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.1332 0.1358
Trichomonas vaginalis DNA helicase recq, putative 0.0015 0.0244 0.0828
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1915 0.1915
Loa Loa (eye worm) hypothetical protein 0.0012 0.014 0.014
Schistosoma mansoni SET domain protein 0.004 0.0903 0.0903
Echinococcus multilocularis hepatoma derived growth factor protein 0.0011 0.0134 0.0134
Schistosoma mansoni hypothetical protein 0.0013 0.0167 0.0167
Plasmodium vivax importin-beta 2, putative 0.0035 0.0773 1
Schistosoma mansoni elf1 0.0013 0.0167 0.0167
Loa Loa (eye worm) hypothetical protein 0.0365 0.9815 0.9815
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0012 0.0147 0.1906
Schistosoma mansoni polyomavirus enhancer activator 3 pea3 0.0013 0.0167 0.0167
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0012 0.014 0.0475
Echinococcus multilocularis protein C ets 2 0.0013 0.0167 0.0167
Echinococcus multilocularis GA binding protein alpha chain 0.0087 0.2215 0.2215
Echinococcus granulosus multidrug resistance protein 1 0.0008 0.0043 0.0043
Loa Loa (eye worm) isocitrate dehydrogenase 0.0019 0.0342 0.0342
Entamoeba histolytica hypothetical protein 0.0011 0.0134 0.0456
Loa Loa (eye worm) hypothetical protein 0.0012 0.0147 0.0147
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0.0342 0.4425
Brugia malayi hypothetical protein 0.0011 0.0134 0.0137
Trichomonas vaginalis ABC transporter, half transporter, putative 0.0012 0.014 0.0475
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0012 0.014 0.0475
Echinococcus granulosus peregrin 0.0011 0.0134 0.0134
Schistosoma mansoni tar DNA-binding protein 0.0076 0.1915 0.1915
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0653 0.8448
Loa Loa (eye worm) RNA binding protein 0.0076 0.1915 0.1915
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0342 0.0342
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0342 0.0342
Entamoeba histolytica Ran family GTPase 0.0026 0.0521 0.1772
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.2944 1
Brugia malayi RNA binding protein 0.0076 0.1915 0.1951
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0653 0.1847
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0114 0.2944 0.2944
Schistosoma mansoni ets-related 0.0265 0.7091 0.7091
Trichomonas vaginalis multidrug resistance protein 1, 2, putative 0.0012 0.014 0.0475
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0019 0.0342 0.4425
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1332 0.1332
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.1332 0.1332
Schistosoma mansoni ran 0.0026 0.0521 0.0521
Leishmania major importin beta-1 subunit, putative 0.0028 0.0593 0.2014
Echinococcus granulosus protein C ets 2 0.0013 0.0167 0.0167
Echinococcus multilocularis isocitrate dehydrogenase 0.0019 0.0342 0.0342
Schistosoma mansoni blooms syndrome DNA helicase 0.0023 0.0447 0.0447
Schistosoma mansoni hypothetical protein 0.0372 1 1
Loa Loa (eye worm) RecQ helicase 0.0029 0.0614 0.0614
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0012 0.014 0.014
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0372 1 1
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0026 0.0521 0.0531
Echinococcus granulosus bloom syndrome protein 0.0029 0.0614 0.0614
Echinococcus granulosus hepatoma derived growth factor protein 0.0011 0.0134 0.0134
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.2944 0.2944
Echinococcus granulosus histone lysine N methyltransferase H3 lysine 36 0.0013 0.0171 0.0171
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0019 0.0342 1
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0012 0.0147 0.0147
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0147 0.015
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0012 0.014 0.0475
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0342 0.074
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0593 0.2014
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0014 0.0194 0.0194
Echinococcus multilocularis ATP binding cassette sub family B 0.0012 0.0136 0.0136
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0012 0.014 0.014
Brugia malayi multidrug resistance protein 3 0.0012 0.014 0.0143
Echinococcus granulosus geminin 0.0205 0.5424 0.5424
Trichomonas vaginalis ATP-binding cassette transporter, putative 0.0012 0.014 0.0475
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.2944 1
Leishmania major GTP-binding protein, putative 0.0026 0.0521 0.1772
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0019 0.0342 0.0342
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0147 0.1906
Brugia malayi Ets-domain containing protein 0.0013 0.0167 0.017
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0012 0.014 0.0475
Leishmania major p-glycoprotein 0.0012 0.014 0.0475
Echinococcus granulosus multidrug resistance protein 1 0.0012 0.014 0.014
Schistosoma mansoni hypothetical protein 0.0205 0.5424 0.5424
Entamoeba histolytica serine/threonine protein kinase, putative 0.0114 0.2944 1
Trichomonas vaginalis abcb9, putative 0.0012 0.014 0.0475
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0147 0.015
Loa Loa (eye worm) hypothetical protein 0.0035 0.0773 0.0773
Echinococcus multilocularis ETS transcription factor Elf 2 0.0013 0.0167 0.0167
Loa Loa (eye worm) PWWP domain-containing protein 0.0011 0.0134 0.0134
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.1332 0.1332
Schistosoma mansoni ets-related 0.0013 0.0167 0.0167
Entamoeba histolytica P-glycoprotein 5, putative 0.0012 0.014 0.0475
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0026 0.0521 0.0521
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0026 0.0521 0.6744
Echinococcus granulosus ETS domain containing protein Elk 1 0.0013 0.0167 0.0167
Trichomonas vaginalis abcb9, putative 0.0012 0.014 0.0475
Echinococcus multilocularis ETS domain containing protein Elk 1 0.0013 0.0167 0.0167
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0012 0.0147 0.0147
Schistosoma mansoni SET domain protein 0.0013 0.0171 0.0171
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0593 0.2014
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.2944 1
Trichomonas vaginalis lipid A export ATP-binding/permease protein msba, putative 0.0012 0.014 0.0475
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0012 0.0147 0.0147
Brugia malayi PWWP domain containing protein 0.0011 0.0134 0.0137
Brugia malayi hypothetical protein 0.0365 0.9815 1
Schistosoma mansoni ets 0.0013 0.0167 0.0167
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.0012 0.014 0.014
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0026 0.0521 0.0521
Echinococcus multilocularis ewsr:fli fusion protein type 0.0013 0.0167 0.0167
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.0012 0.014 0.014
Loa Loa (eye worm) hypothetical protein 0.003 0.0653 0.0653
Trichomonas vaginalis taga, putative 0.0012 0.014 0.0475
Toxoplasma gondii hypothetical protein 0.0011 0.0134 0.1738
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.1915 0.1915

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -5.607 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.937 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.752 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.713 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.689 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.675 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.656 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.505 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.152 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

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

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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