Detailed information for compound 1847192

Basic information

Technical information
  • TDR Targets ID: 1847192
  • Name: [(2R,3S,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hyd roxyoxolan-2-yl]methyl diphenyl phosphate
  • MW: 460.374 | Formula: C21H21N2O8P
  • H donors: 2 H acceptors: 4 LogP: 1.73 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: O[C@H]1C[C@@H](O[C@@H]1COP(=O)(Oc1ccccc1)Oc1ccccc1)n1ccc(=O)[nH]c1=O
  • InChi: 1S/C21H21N2O8P/c24-17-13-20(23-12-11-19(25)22-21(23)26)29-18(17)14-28-32(27,30-15-7-3-1-4-8-15)31-16-9-5-2-6-10-16/h1-12,17-18,20,24H,13-14H2,(H,22,25,26)/t17-,18+,20+/m0/s1
  • InChiKey: IHWNCZRHSNSIGL-NLWGTHIKSA-N  

Network

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Synonyms

  • [(2R,3S,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl diphenyl phosphate
  • phosphoric acid [(2R,3S,5R)-5-(2,4-dioxo-1-pyrimidinyl)-3-hydroxy-2-tetrahydrofuranyl]methyl diphenyl ester
  • phosphoric acid [(2R,3S,5R)-5-(2,4-diketopyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl diphenyl ester
  • [(2R,3S,5R)-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-oxolan-2-yl]methyl diphenyl phosphate

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
Echinococcus granulosus multidrug resistance protein 1 0.00197218 0.000900114 0.00125373
Trypanosoma brucei alpha tubulin 0.0171756 0.526614 0.732087
Onchocerca volvulus 0.00255429 0.0210286 0.0252784
Echinococcus granulosus beta tubulin 0.0227089 0.71795 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0171756 0.526614 0.660218
Trypanosoma brucei epsilon tubulin 0.0123034 0.35814 0.496187
Entamoeba histolytica ABC transporter, putative 0.00704352 0.176261 0.220227
Echinococcus multilocularis tubulin alpha chain 0.0171756 0.526614 0.733497
Brugia malayi Tubulin beta-1 chain 0.0227089 0.71795 0.900507
Plasmodium vivax ABC transporter G family member 2, putative 0.00704352 0.176261 0.244559
Plasmodium vivax hypothetical protein, conserved 0.00217364 0.00786626 0.009715
Trichomonas vaginalis tubulin beta chain, putative 0.0171756 0.526614 0.660218
Trichomonas vaginalis tubulin, putative 0.00534198 0.117424 0.146336
Echinococcus multilocularis tubulin subunit beta 0.0227089 0.71795 1
Loa Loa (eye worm) hypothetical protein 0.0101797 0.284707 0.357145
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00197218 0.000900114 0.00125373
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.00534198 0.117424 0.162504
Plasmodium vivax tubulin alpha chain, putative 0.0171756 0.526614 0.733162
Schistosoma mansoni amine oxidase 0.00217364 0.00786626 0.009715
Echinococcus granulosus ATP binding cassette sub family G 0.00704352 0.176261 0.245506
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Leishmania major beta tubulin 0.0227089 0.71795 1
Loa Loa (eye worm) tubulin alpha chain 0.0171756 0.526614 0.660601
Loa Loa (eye worm) tubulin alpha-2 chain 0.0171756 0.526614 0.660601
Loa Loa (eye worm) hypothetical protein 0.00217364 0.00786626 0.00986768
Echinococcus multilocularis tubulin subunit TubB 0.0171756 0.526614 0.733497
Leishmania major beta tubulin 0.0227089 0.71795 1
Echinococcus granulosus ATP binding cassette sub family G 0.00704352 0.176261 0.245506
Echinococcus multilocularis protoporphyrinogen oxidase 0.00217364 0.00786626 0.0109566
Onchocerca volvulus Peroxidase homolog 0.00255429 0.0210286 0.0252784
Brugia malayi amine oxidase, flavin-containing family protein 0.00217364 0.00786626 0.00874843
Schistosoma mansoni alpha tubulin 0.0171756 0.526614 0.733162
Giardia lamblia Beta tubulin 0.0227089 0.71795 0.883452
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.00534198 0.117424 0.5
Leishmania major p450 reductase, putative 0.00205537 0.00377683 0.00401187
Brugia malayi Peroxidasin 0.00255429 0.0210286 0.0252784
Toxoplasma gondii beta tubulin 0.0227089 0.71795 1
Loa Loa (eye worm) hypothetical protein 0.00197218 0.000900114 0.00112913
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00197218 0.000900114 0.00125373
Echinococcus multilocularis tumor necrosis factor receptor superfamily 0.0113509 0.325205 0.452963
Entamoeba histolytica protein tyrosine phosphatase, putative 0.025 0.797174 1
Echinococcus granulosus death domain containing protein 0.00882757 0.237951 0.331431
Loa Loa (eye worm) hypothetical protein 0.00217364 0.00786626 0.00986768
Trypanosoma brucei zeta tubulin, putative 0.00534198 0.117424 0.159131
Leishmania major beta tubulin 0.0227089 0.71795 1
Trypanosoma cruzi ABC transporter, putative 0.00704352 0.176261 0.241516
Giardia lamblia Beta tubulin 0.0227089 0.71795 0.883452
Plasmodium vivax tubulin alpha chain, putative 0.0171756 0.526614 0.733162
Giardia lamblia ABC transporter 0.00701749 0.175361 0.085233
Plasmodium vivax protoporphyrinogen oxidase, putative 0.00217364 0.00786626 0.009715
Loa Loa (eye worm) tubulin beta-2A chain 0.0227089 0.71795 0.90062
Leishmania major beta tubulin 0.0227089 0.71795 1
Leishmania major beta tubulin 0.0227089 0.71795 1
Schistosoma mansoni Lysine-specific histone demethylase 1 0.00217364 0.00786626 0.009715
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00197218 0.000900114 0.00125373
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0118336 0.341895 0.428238
Plasmodium vivax tubulin epsilon chain, putative 0.0123034 0.35814 0.498208
Giardia lamblia Beta tubulin 0.0227089 0.71795 0.883452
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.025 0.797174 0.796405
Leishmania major beta tubulin 0.0227089 0.71795 1
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Plasmodium falciparum ABC transporter G family member 2 0.00704352 0.176261 0.244559
Plasmodium falciparum nitric oxide synthase, putative 0.00205537 0.00377683 0.00401187
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Trichomonas vaginalis tubulin epsilon chain, putative 0.0227089 0.71795 0.900507
Schistosoma mansoni tumor necrosis factor receptor related 0.0113509 0.325205 0.452276
Trypanosoma cruzi UDP-galactopyranose mutase 0.00217364 0.00786626 0.0057261
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Echinococcus multilocularis ATP binding cassette sub family G 0.00704352 0.176261 0.245506
Echinococcus granulosus Tubulin alpha 1 chain 0.0171756 0.526614 0.733497
Schistosoma mansoni tubulin subunit beta 0.0227089 0.71795 1
Schistosoma mansoni tubulin subunit gamma 0.0123034 0.35814 0.498208
Loa Loa (eye worm) blistered cuticle protein 3 0.00255429 0.0210286 0.026379
Brugia malayi alpha-tubulin 0.0171756 0.526614 0.660218
Trichomonas vaginalis tubulin alpha chain, putative 0.0069614 0.173421 0.21666
Schistosoma mansoni tubulin subunit beta 0.0227089 0.71795 1
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Loa Loa (eye worm) hypothetical protein 0.00217364 0.00786626 0.00986768
Brugia malayi Tubulin alpha-2 chain 0.0171756 0.526614 0.660218
Loa Loa (eye worm) tubulin alpha 2 0.0118336 0.341895 0.428884
Echinococcus granulosus multidrug resistance protein 1 0.00197218 0.000900114 0.00125373
Leishmania major beta tubulin 0.0227089 0.71795 1
Schistosoma mansoni ABC transporter 0.00600032 0.140188 0.194252
Echinococcus multilocularis tubulin alpha chain 0.0171756 0.526614 0.733497
Loa Loa (eye worm) hypothetical protein 0.00217364 0.00786626 0.00986768
Brugia malayi hypothetical protein 0.00217364 0.00786626 0.00874843
Brugia malayi Immunoglobulin I-set domain containing protein 0.00882757 0.237951 0.2977
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.025 0.797174 1
Giardia lamblia Gamma tubulin 0.0123034 0.35814 0.354125
Echinococcus granulosus tubulin alpha chain 0.0171756 0.526614 0.733497
Echinococcus multilocularis peroxisome assembly protein 26 0.0171756 0.526614 0.733497
Echinococcus granulosus peroxidasin 0.00255429 0.0210286 0.0292898
Echinococcus multilocularis tubulin epsilon chain 0.0123034 0.35814 0.498837
Loa Loa (eye worm) beta-tubulin 0.0227089 0.71795 0.90062
Trypanosoma brucei alpha tubulin 0.0171756 0.526614 0.732087
Toxoplasma gondii alpha-tubulin I, putative 0.0171756 0.526614 0.733162
Mycobacterium leprae cell division protein FtsZ 0.00534198 0.117424 1
Trichomonas vaginalis tubulin, putative 0.0069614 0.173421 0.21666
Schistosoma mansoni tubulin subunit beta 0.0227089 0.71795 1
Schistosoma mansoni tubulin subunit beta 0.0227089 0.71795 1
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.025 0.797174 1
Mycobacterium ulcerans monoamine oxidase 0.00217364 0.00786626 0.00410493
Loa Loa (eye worm) hypothetical protein 0.00882757 0.237951 0.298493
Brugia malayi Animal haem peroxidase family protein 0.00255429 0.0210286 0.0252784
Echinococcus granulosus tubulin alpha 3 chain 0.0171756 0.526614 0.733497
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0308656 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0123034 0.35814 0.44864
Leishmania major ATP-binding cassette protein subfamily G, member 6, putative 0.00704352 0.176261 0.244559
Echinococcus granulosus NADPH cytochrome P450 reductase 0.00205537 0.00377683 0.00526057
Toxoplasma gondii histone lysine-specific demethylase 0.00217364 0.00786626 0.009715
Echinococcus multilocularis Tubulin beta 2C chain 0.0227089 0.71795 1
Leishmania major ATP-binding cassette protein subfamily G, member 4, putative 0.00704352 0.176261 0.244559
Schistosoma mansoni peroxidasin 0.00255429 0.0210286 0.0280713
Echinococcus granulosus Tubulin alpha 1 chain 0.0171756 0.526614 0.733497
Trichomonas vaginalis tubulin gamma chain, putative 0.00534198 0.117424 0.146336
Entamoeba histolytica tubulin gamma chain 0.0123034 0.35814 0.44864
Brugia malayi Tubulin beta chain 0.00534198 0.117424 0.146336
Echinococcus multilocularis tubulin alpha chain 0.0171756 0.526614 0.733497
Echinococcus multilocularis tubulin alpha 3 chain 0.0171756 0.526614 0.733497
Trypanosoma cruzi tubulin delta chain 0.00534198 0.117424 0.159131
Echinococcus multilocularis ATP binding cassette sub family G 0.00704352 0.176261 0.245506
Echinococcus multilocularis Ankyrin 0.00882757 0.237951 0.331431
Echinococcus multilocularis TNFR CD27 30 40 95 cysteine rich region 0.0113509 0.325205 0.452963
Trypanosoma cruzi zeta tubulin, putative 0.00534198 0.117424 0.159131
Loa Loa (eye worm) animal heme peroxidase 0.00255429 0.0210286 0.026379
Echinococcus multilocularis Tubulin alpha 1 chain 0.0171756 0.526614 0.733497
Echinococcus granulosus tubulin alpha chain 0.0171756 0.526614 0.733497
Trypanosoma cruzi beta tubulin, putative 0.0227089 0.71795 1
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.00217364 0.00786626 0.009715
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00197218 0.000900114 0.00125373
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.00534198 0.117424 0.162504
Trichomonas vaginalis tubulin gamma chain, putative 0.0227089 0.71795 0.900507
Trypanosoma brucei tubulin gamma chain 0.0123034 0.35814 0.496187
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Leishmania major delta tubulin, putative 0.00534198 0.117424 0.162504
Echinococcus granulosus Tubulin beta 2C chain 0.0227089 0.71795 1
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.00217364 0.00786626 0.009715
Mycobacterium ulcerans oxidoreductase 0.00217364 0.00786626 0.00410493
Trypanosoma brucei beta tubulin 0.0227089 0.71795 1
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0171756 0.526614 0.660218
Echinococcus granulosus ATP binding cassette sub family G 0.00704352 0.176261 0.245506
Loa Loa (eye worm) alpha-tubulin 0.0171756 0.526614 0.660601
Trichomonas vaginalis conserved hypothetical protein 0.00534198 0.117424 0.146336
Echinococcus granulosus tubulin alpha 3 chain 0.0171756 0.526614 0.733497
Leishmania major beta tubulin 0.0227089 0.71795 1
Brugia malayi tubulin alpha chain - mouse 0.0171756 0.526614 0.660218
Trypanosoma brucei tubulin delta chain 0.00534198 0.117424 0.159131
Echinococcus multilocularis ankyrin repeat and death domain containing protein 0.00882757 0.237951 0.331431
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0069614 0.173421 0.21666
Loa Loa (eye worm) tubulin gamma chain 0.0123034 0.35814 0.449262
Trypanosoma brucei ABC transporter, putative 0.00704352 0.176261 0.241516
Leishmania major beta tubulin 0.0227089 0.71795 1
Mycobacterium ulcerans dehydrogenase 0.00217364 0.00786626 0.00410493
Trichomonas vaginalis tubulin gamma chain, putative 0.0123034 0.35814 0.44864
Echinococcus granulosus NADPH dependent diflavin oxidoreductase 1 0.00205537 0.00377683 0.00526057
Schistosoma mansoni tubulin subunit alpha 0.0171756 0.526614 0.733162
Toxoplasma gondii alpha tubulin TUBA1 0.0171756 0.526614 0.733162
Entamoeba histolytica tubulin family protein 0.0227089 0.71795 0.900507
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.00217364 0.00786626 0.009715
Loa Loa (eye worm) tubulin alpha chain 0.0171756 0.526614 0.660601
Onchocerca volvulus Peroxidasin homolog 0.00255429 0.0210286 0.0252784
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.028692 0.924838 1
Plasmodium falciparum alpha tubulin 2 0.0171756 0.526614 0.733162
Brugia malayi tubulin alpha-2 chain 0.0171756 0.526614 0.660218
Trypanosoma brucei epsilon tubulin 0.0123034 0.35814 0.496187
Loa Loa (eye worm) hypothetical protein 0.0171756 0.526614 0.660601
Echinococcus granulosus tubulin alpha 0.0123034 0.35814 0.498837
Trypanosoma cruzi tubulin delta chain 0.00534198 0.117424 0.159131
Schistosoma mansoni cytochrome P450 reductase 0.00205537 0.00377683 0.00401187
Echinococcus multilocularis tubulin alpha 1C chain 0.0171756 0.526614 0.733497
Trichomonas vaginalis tubulin epsilon chain, putative 0.0171756 0.526614 0.660218
Loa Loa (eye worm) ABC transporter 0.00600032 0.140188 0.175857
Leishmania major beta tubulin 0.0227089 0.71795 1
Leishmania major beta tubulin 0.0227089 0.71795 1
Brugia malayi Tubulin beta chain 0.0069614 0.173421 0.21666
Leishmania major beta tubulin 0.0227089 0.71795 1
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Schistosoma mansoni tubulin subunit delta 0.00534198 0.117424 0.162504
Echinococcus granulosus beta tubulin 0.0227089 0.71795 1
Echinococcus granulosus tubulin alpha chain 0.0171756 0.526614 0.733497
Giardia lamblia Alpha-tubulin 0.0171756 0.526614 0.601972
Loa Loa (eye worm) tubulin beta-4 chain 0.0227089 0.71795 0.90062
Echinococcus multilocularis Tubulin beta 2C chain 0.0227089 0.71795 1
Echinococcus granulosus Tubulin alpha 1 chain 0.0171756 0.526614 0.733497
Loa Loa (eye worm) tubulin alpha-3 chain 0.0102142 0.285897 0.358639
Echinococcus granulosus tubulin alpha 1C chain 0.0171756 0.526614 0.733497
Echinococcus granulosus multidrug resistance protein 1 0.00197218 0.000900114 0.00125373
Echinococcus multilocularis netrin receptor unc 5 0.00882757 0.237951 0.331431
Leishmania major beta tubulin 0.0227089 0.71795 1
Brugia malayi hypothetical protein 0.00255429 0.0210286 0.0252784
Brugia malayi ABC transporter family protein 0.00600032 0.140188 0.174925
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Echinococcus multilocularis Tubulin alpha 1 chain 0.0171756 0.526614 0.733497
Trypanosoma brucei alpha tubulin 0.0171756 0.526614 0.732087
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.00704352 0.176261 0.173138
Entamoeba histolytica tubulin alpha chain, putative 0.0171756 0.526614 0.660218
Trichomonas vaginalis tubulin beta chain, putative 0.0171756 0.526614 0.660218
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0227089 0.71795 1
Onchocerca volvulus 0.00255429 0.0210286 0.0252784
Brugia malayi Tubulin alpha chain 0.00534198 0.117424 0.146336
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.025 0.797174 1
Echinococcus multilocularis tubulin alpha 0.0123034 0.35814 0.498837
Loa Loa (eye worm) hypothetical protein 0.00510557 0.109249 0.137045
Schistosoma mansoni amine oxidase 0.00217364 0.00786626 0.009715
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.025 0.797174 1
Loa Loa (eye worm) hypothetical protein 0.00882757 0.237951 0.298493
Echinococcus granulosus Tubulin beta 2C chain 0.0227089 0.71795 1
Echinococcus multilocularis hypothetical protein 0.0171756 0.526614 0.733497
Plasmodium falciparum tubulin gamma chain 0.0123034 0.35814 0.498208
Loa Loa (eye worm) tubulin beta-1 chain 0.0227089 0.71795 0.90062
Trypanosoma brucei beta tubulin 0.0123034 0.35814 0.496187
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Echinococcus multilocularis beta tubulin 0.0227089 0.71795 1
Echinococcus granulosus ankyrin repeat and death domain containing protein 0.00882757 0.237951 0.331431
Echinococcus multilocularis multidrug resistance protein 1 0.00197218 0.000900114 0.00125373
Plasmodium vivax NADPH-cytochrome p450 reductase, putative 0.00205537 0.00377683 0.00401187
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Echinococcus multilocularis tubulin gamma 1 chain 0.0123034 0.35814 0.498837
Echinococcus multilocularis Tubulin beta 2C chain 0.0227089 0.71795 1
Echinococcus granulosus tubulin beta 4A class IVa 0.0227089 0.71795 1
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.025 0.797174 1
Brugia malayi beta-tubulin, identical 0.0227089 0.71795 0.900507
Echinococcus granulosus Tubulin beta 2C chain 0.0227089 0.71795 1
Loa Loa (eye worm) multidrug resistance protein 3 0.00197218 0.000900114 0.00112913
Loa Loa (eye worm) alpha-tubulin 0.0171756 0.526614 0.660601
Trichomonas vaginalis tubulin beta chain, putative 0.0171756 0.526614 0.660218
Loa Loa (eye worm) ATP-binding cassette sub-family B member 2 0.00197218 0.000900114 0.00112913
Trypanosoma brucei zeta tubulin 0.00534198 0.117424 0.159131
Echinococcus granulosus Tubulin beta 2C chain 0.0227089 0.71795 1
Echinococcus granulosus tubulin alpha chain 0.0171756 0.526614 0.733497
Toxoplasma gondii ATP-binding cassette G family transporter ABCG84 0.00704352 0.176261 0.244559
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00197218 0.000900114 0.00125373
Schistosoma mansoni hypothetical protein 0.00597429 0.139288 0.192996
Leishmania major beta tubulin 0.0227089 0.71795 1
Echinococcus multilocularis lysine specific histone demethylase 1A 0.00217364 0.00786626 0.0109566
Trichomonas vaginalis tubulin beta chain, putative 0.0171756 0.526614 0.660218
Loa Loa (eye worm) tubulin alpha 2 0.0118336 0.341895 0.428884
Echinococcus granulosus tubulin alpha chain 0.0171756 0.526614 0.733497
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.00217364 0.00786626 0.009715
Echinococcus multilocularis tubulin alpha chain 0.0171756 0.526614 0.733497
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Schistosoma mansoni alpha tubulin 0.0171756 0.526614 0.733162
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0102142 0.285897 0.357914
Echinococcus granulosus tubulin epsilon chain 0.0123034 0.35814 0.498837
Mycobacterium tuberculosis Cell division protein FtsZ 0.00534198 0.117424 0.126116
Echinococcus multilocularis ATP binding cassette subfamily B (MDR:TAP) 0.00197218 0.000900114 0.00125373
Mycobacterium ulcerans cell division protein FtsZ 0.00534198 0.117424 0.114078
Trypanosoma cruzi alpha tubulin, putative 0.0171756 0.526614 0.732087
Trypanosoma brucei epsilon tubulin 0.0123034 0.35814 0.496187
Leishmania major zeta tubulin, putative 0.00534198 0.117424 0.162504
Loa Loa (eye worm) hypothetical protein 0.0188883 0.585838 0.734894
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.025 0.797174 1
Loa Loa (eye worm) animal heme peroxidase 0.00255429 0.0210286 0.026379
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Echinococcus multilocularis tubulin alpha 1C chain 0.0171756 0.526614 0.733497
Onchocerca volvulus Peroxidase homolog 0.00255429 0.0210286 0.0252784
Leishmania major epsilon tubulin, putative 0.0123034 0.35814 0.498208
Loa Loa (eye worm) tubulin alpha 2 0.00487218 0.101178 0.126922
Leishmania major NADPH-cytochrome p450 reductase-like protein 0.00205537 0.00377683 0.00401187
Trichomonas vaginalis tubulin alpha chain, putative 0.0069614 0.173421 0.21666
Trichomonas vaginalis tubulin beta chain, putative 0.0069614 0.173421 0.21666
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.025 0.797174 1
Toxoplasma gondii beta-tubulin, putative 0.0227089 0.71795 1
Entamoeba histolytica tubulin alpha-1 chain 0.0171756 0.526614 0.660218
Echinococcus multilocularis Tubulin beta 2C chain 0.0227089 0.71795 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0227089 0.71795 0.900507
Onchocerca volvulus Netrin receptor homolog 0.00882757 0.237951 0.2977
Leishmania major beta tubulin 0.0227089 0.71795 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.00217364 0.00786626 0.00753962
Plasmodium falciparum protoporphyrinogen oxidase 0.00217364 0.00786626 0.009715
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.00704352 0.176261 0.244559
Echinococcus granulosus netrin receptor unc 5 0.00882757 0.237951 0.331431
Echinococcus granulosus lysine specific histone demethylase 1A 0.00217364 0.00786626 0.0109566
Loa Loa (eye worm) BEN-1 protein 0.0227089 0.71795 0.90062
Trypanosoma brucei beta tubulin 0.0227089 0.71795 1
Brugia malayi Blistered cuticle protein 3 0.00255429 0.0210286 0.0252784
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00197218 0.000900114 0.00125373
Trichomonas vaginalis tubulin beta-1 chain, putative 0.00534198 0.117424 0.146336
Trichomonas vaginalis tubulin epsilon chain, putative 0.00534198 0.117424 0.146336
Echinococcus multilocularis beta tubulin 0.0227089 0.71795 1
Schistosoma mansoni tubulin subunit alpha 0.0171756 0.526614 0.733162
Echinococcus multilocularis tubulin delta chain 0.00534198 0.117424 0.163554
Schistosoma mansoni tubulin subunit alpha 0.0171756 0.526614 0.733162
Trypanosoma cruzi epsilon tubulin, putative 0.0123034 0.35814 0.496187
Onchocerca volvulus 0.025 0.797174 1
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Echinococcus multilocularis multidrug resistance protein 1 0.00197218 0.000900114 0.00125373
Echinococcus multilocularis tubulin alpha chain 0.0171756 0.526614 0.733497
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.00704352 0.176261 0.173138
Loa Loa (eye worm) hypothetical protein 0.00205537 0.00377683 0.00473777
Trichomonas vaginalis tubulin, putative 0.0069614 0.173421 0.21666
Brugia malayi Protein kinase domain containing protein 0.00882757 0.237951 0.2977
Brugia malayi Animal haem peroxidase family protein 0.00255429 0.0210286 0.0252784
Brugia malayi flavodoxin family protein 0.00205537 0.00377683 0.00361272
Loa Loa (eye worm) hypothetical protein 0.0118336 0.341895 0.428884
Echinococcus granulosus tubulin delta chain 0.00534198 0.117424 0.163554
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Echinococcus granulosus lysine specific histone demethylase 1A 0.00217364 0.00786626 0.0109566
Onchocerca volvulus Dual oxidase homolog 0.00255429 0.0210286 0.0252784
Schistosoma mansoni ankyrin 23/unc44 0.00882757 0.237951 0.330592
Trichomonas vaginalis sulfite reductase, putative 0.00205537 0.00377683 0.00361272
Echinococcus granulosus tubulin subunit beta 0.0227089 0.71795 1
Schistosoma mansoni retinoblastoma-binding protein 4 (rbbp4) 0.00882757 0.237951 0.330592
Leishmania major UDP-galactopyranose mutase 0.00217364 0.00786626 0.009715
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.025 0.797174 1
Trichomonas vaginalis conserved hypothetical protein 0.00534198 0.117424 0.146336
Schistosoma mansoni peroxidasin 0.00255429 0.0210286 0.0280713
Leishmania major beta tubulin 0.0227089 0.71795 1
Schistosoma mansoni tubulin subunit beta 0.0227089 0.71795 1
Loa Loa (eye worm) FAD binding domain-containing protein 0.00205537 0.00377683 0.00473777
Leishmania major beta tubulin 0.0227089 0.71795 1
Loa Loa (eye worm) hypothetical protein 0.00217364 0.00786626 0.00986768
Plasmodium vivax tubulin gamma chain, putative 0.0123034 0.35814 0.498208
Echinococcus multilocularis tubulin alpha 3 chain 0.0171756 0.526614 0.733497
Brugia malayi Tubulin gamma chain 0.0123034 0.35814 0.44864
Loa Loa (eye worm) hypothetical protein 0.0102142 0.285897 0.358639
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0308656 1 1
Trypanosoma brucei beta tubulin 0.0227089 0.71795 1
Schistosoma mansoni tubulin subunit epsilon 0.0123034 0.35814 0.498208
Echinococcus multilocularis tubulin beta 1 chain 0.0227089 0.71795 1
Trypanosoma cruzi UDP-galactopyranose mutase 0.00217364 0.00786626 0.0057261
Echinococcus multilocularis NADPH cytochrome P450 reductase 0.00205537 0.00377683 0.00526057
Echinococcus multilocularis 0.00217364 0.00786626 0.0109566
Loa Loa (eye worm) hypothetical protein 0.00197218 0.000900114 0.00112913
Echinococcus granulosus alpha tubulin 0.0171756 0.526614 0.733497
Treponema pallidum cell division protein FtsZ 0.00534198 0.117424 0.5
Schistosoma mansoni netrin receptor unc5 0.00882757 0.237951 0.330592
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.00217364 0.00786626 0.009715
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Trichomonas vaginalis tubulin, putative 0.0227089 0.71795 0.900507
Loa Loa (eye worm) BEN-1 protein 0.0227089 0.71795 0.90062
Brugia malayi Death domain containing protein 0.00882757 0.237951 0.2977
Schistosoma mansoni alpha tubulin 0.0171756 0.526614 0.733162
Onchocerca volvulus 0.00255429 0.0210286 0.0252784
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00197218 0.000900114 0.00125373
Echinococcus granulosus tubulin subunit TubB 0.0171756 0.526614 0.733497
Plasmodium vivax hypothetical protein, conserved 0.00217364 0.00786626 0.009715
Trichomonas vaginalis tubulin alpha chain, putative 0.0069614 0.173421 0.21666
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Brugia malayi Uncoordinated protein 44 0.00882757 0.237951 0.2977
Brugia malayi Animal haem peroxidase family protein 0.00255429 0.0210286 0.0252784
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Loa Loa (eye worm) tubulin beta chain 0.0227089 0.71795 0.90062
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.0123034 0.35814 0.498208
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Schistosoma mansoni alzheimer's disease beta-amyloid related 0.00870855 0.233836 0.324852
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Loa Loa (eye worm) hypothetical protein 0.00217364 0.00786626 0.00986768
Loa Loa (eye worm) alpha-tubulin isotype 2 0.0118336 0.341895 0.428884
Echinococcus granulosus tubulin beta 1 chain 0.0227089 0.71795 1
Brugia malayi Animal haem peroxidase family protein 0.00255429 0.0210286 0.0252784
Mycobacterium tuberculosis Possible oxidoreductase 0.00217364 0.00786626 0.00753962
Chlamydia trachomatis protoporphyrinogen oxidase 0.00217364 0.00786626 1
Schistosoma mansoni hypothetical protein 0.00882757 0.237951 0.330592
Trypanosoma cruzi epsilon tubulin, putative 0.0123034 0.35814 0.496187
Giardia lamblia Alpha-tubulin 0.0171756 0.526614 0.601972
Plasmodium falciparum alpha tubulin 1 0.0171756 0.526614 0.733162
Plasmodium falciparum tubulin delta chain, putative 0.00534198 0.117424 0.162504
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Echinococcus multilocularis peroxidasin 0.00255429 0.0210286 0.0292898
Trypanosoma brucei beta tubulin 0.0227089 0.71795 1
Loa Loa (eye worm) tubulin beta chain 0.00534198 0.117424 0.1473
Plasmodium falciparum tubulin beta chain 0.0227089 0.71795 1
Trichomonas vaginalis tubulin beta chain, putative 0.0171756 0.526614 0.660218
Echinococcus granulosus Ankyrin 0.00882757 0.237951 0.331431
Brugia malayi Cell division protein ftsZ 0.00534198 0.117424 0.146336
Echinococcus granulosus peroxisome assembly protein 26 0.0171756 0.526614 0.733497
Plasmodium vivax tubulin beta chain, putative 0.0227089 0.71795 1
Onchocerca volvulus 0.00217364 0.00786626 0.00874843
Echinococcus granulosus ATP binding cassette subfamily B MDR:TAP 0.00197218 0.000900114 0.00125373
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Trypanosoma cruzi ATP-binding cassette protein, putative 0.00704352 0.176261 0.241516
Plasmodium vivax delta tubulin, putative 0.00534198 0.117424 0.162504
Entamoeba histolytica tubulin family protein 0.0227089 0.71795 0.900507
Echinococcus multilocularis NADPH dependent diflavin oxidoreductase 1 0.00205537 0.00377683 0.00526057
Schistosoma mansoni tubulin subunit beta 0.0227089 0.71795 1
Trypanosoma cruzi zeta tubulin, putative 0.00534198 0.117424 0.159131
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.025 0.797174 0.861825
Brugia malayi Tubulin alpha chain 0.0171756 0.526614 0.660218
Mycobacterium tuberculosis Probable conserved transmembrane ATP-binding protein ABC transporter 0.00597429 0.139288 0.149781
Onchocerca volvulus 0.0069614 0.173421 0.21666
Leishmania major beta tubulin 0.0227089 0.71795 1
Echinococcus granulosus tubulin alpha 1C chain 0.0171756 0.526614 0.733497
Leishmania major alpha tubulin 0.0171756 0.526614 0.733162
Brugia malayi Low molecular weight phosphotyrosine protein phosphatase containing protein 0.025 0.797174 1
Brugia malayi Amyloid A4 extracellular domain containing protein 0.0239624 0.761296 0.954943
Trypanosoma cruzi tubulin gamma chain 0.0123034 0.35814 0.496187
Entamoeba histolytica protein tyrosine phosphatase, putative 0.025 0.797174 1
Toxoplasma gondii beta-1 tubulin, putative 0.0227089 0.71795 1
Echinococcus multilocularis Tubulin alpha 1 chain 0.0171756 0.526614 0.733497
Leishmania major gamma-tubulin 0.0123034 0.35814 0.498208
Schistosoma mansoni tubulin subunit alpha 0.00534198 0.117424 0.162504
Loa Loa (eye worm) hypothetical protein 0.00255429 0.0210286 0.026379
Mycobacterium ulcerans protoporphyrinogen oxidase 0.00217364 0.00786626 0.00410493
Echinococcus granulosus TNFR CD27 30 40 95 cysteine rich region 0.0113509 0.325205 0.452963
Brugia malayi SWIRM domain containing protein 0.00217364 0.00786626 0.00874843
Echinococcus granulosus tubulin gamma 1 chain 0.0123034 0.35814 0.498837
Plasmodium falciparum tubulin epsilon chain, putative 0.0123034 0.35814 0.498208
Trichomonas vaginalis tubulin alpha chain, putative 0.0227089 0.71795 0.900507
Mycobacterium ulcerans transmembrane ABC transporter ATP-binding protein 0.00704352 0.176261 0.173138
Loa Loa (eye worm) animal heme peroxidase 0.00255429 0.0210286 0.026379
Brugia malayi Tubulin alpha-2 chain 0.0171756 0.526614 0.660218
Trypanosoma brucei alpha tubulin, putative 0.0069614 0.173421 0.237539
Echinococcus multilocularis ATP binding cassette sub family G 0.00704352 0.176261 0.245506
Trypanosoma brucei alpha tubulin 0.0171756 0.526614 0.732087
Loa Loa (eye worm) animal heme peroxidase 0.00255429 0.0210286 0.026379
Schistosoma mansoni tubulin subunit beta 0.00534198 0.117424 0.162504
Trypanosoma brucei ATP-binding cassette protein, putative 0.00704352 0.176261 0.241516
Echinococcus granulosus Tubulin beta 2C chain 0.0227089 0.71795 1
Brugia malayi FAD binding domain containing protein 0.00205537 0.00377683 0.00361272
Onchocerca volvulus Peroxidasin homolog 0.00255429 0.0210286 0.0252784
Echinococcus granulosus tumor necrosis factor receptor superfamily 0.0113509 0.325205 0.452963
Trichomonas vaginalis tubulin beta chain, putative 0.0227089 0.71795 0.900507
Echinococcus multilocularis Tubulin beta 2C chain 0.0227089 0.71795 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0123034 0.35814 0.44864
Trichomonas vaginalis tubulin beta chain, putative 0.0171756 0.526614 0.660218
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.00882757 0.237951 0.298493
Brugia malayi Animal haem peroxidase family protein 0.00255429 0.0210286 0.0252784
Onchocerca volvulus Chorion peroxidase homolog 0.00255429 0.0210286 0.0252784

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) > 11 uM In vitro growth inhibitory activity against Plasmodium falciparum upon incubation at 37 degrees C with compound dissolved in DMSO using [3H]-hypoxanthine (50 uL) ChEMBL. 16161998
IC50 (functional) = 52 uM Inhibitory constant against Trypanosoma brucei rhodesiense upon incubation with the compound at 37 degrees C under a 5% CO2 atmosphere for 72 hours ChEMBL. 16161998
IC50 (functional) > 65 uM In vitro growth inhibitory activity against Leishmania donovani amastigotes at 37 degrees C under a 5% CO2 atmosphere for 96 hours ChEMBL. 16161998
IC50 (functional) > 196 uM In vitro growth inhibitory activity against Trypanosoma cruzi in rat L-6 cells upon incubation at 37 degrees C in 5% CO2 atmosphere for 4 days ChEMBL. 16161998
Ki (binding) > 1 mM Inhibitory constant against Leishmania major deoxyuridine 5'-triphosphate nucleotidohydrolase ChEMBL. 16161998
Ki (binding) = 135 uM Inhibitory constant against human deoxyuridine 5'-triphosphate nucleotidohydrolase expressed in E. coli BL21 (DE3) cells ChEMBL. 16161998
Ki (binding) = 238 uM Inhibitory constant against Plasmodium falciparum deoxyuridine 5'-triphosphate nucleotidohydrolase expressed in E. coli BL21 (DE3) cells ChEMBL. 16161998
SI (binding) = 0.6 Selectivity index for Plasmodium falciparum deoxyuridine 5'-triphosphate nucleotidohydrolase defined as (Ki Human)/(Ki P. falciparum) ChEMBL. 16161998

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 16161998

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

1 literature reference was collected for this gene.

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