Detailed information for compound 558844

Basic information

Technical information
  • TDR Targets ID: 558844
  • Name: 5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymeth yl)tetrahydrofuran-2-yl]-1,3-oxazine-2,4-dion e
  • MW: 245.186 | Formula: C9H11NO7
  • H donors: 4 H acceptors: 5 LogP: -2.23 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)c1coc(=O)[nH]c1=O
  • InChi: 1S/C9H11NO7/c11-1-4-5(12)6(13)7(17-4)3-2-16-9(15)10-8(3)14/h2,4-7,11-13H,1H2,(H,10,14,15)/t4-,5-,6-,7+/m1/s1
  • InChiKey: REFHNSOTFKKRAI-GBNDHIKLSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-1,3-oxazine-2,4-dione
  • 5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-oxazine-2,4-dione
  • 5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-1,3-oxazine-2,4-quinone
  • minimycin
  • 32388-21-9
  • 2H-1,3-Oxazine-2,4(3H)-dione, 5-beta-D-ribofuranosyl-
  • 5-beta-D-Ribofuranosyl-1,3-oxazine-2,4-dione
  • Oxazinomycin
  • AIDS-166758
  • AIDS166758
  • Minimycin, Oxazinomycin

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 coup transcription factor 0.003 0.0173 0.1032
Brugia malayi ecdysteroid receptor 0.003 0.0173 0.0602
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Schistosoma mansoni hypothetical protein 0.0035 0.0229 0.1367
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.003 0.0173 0.0602
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0014 0.0084
Echinococcus granulosus FTZ F1 alpha 0.003 0.0173 0.0602
Echinococcus granulosus retinoic acid receptor rxr beta a 0.003 0.0173 0.0602
Toxoplasma gondii hypothetical protein 0.005 0.041 0.3907
Schistosoma mansoni ap endonuclease 0.0019 0.0031 0.0184
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0023 0.0085 0.3779
Loa Loa (eye worm) hypothetical protein 0.0247 0.2779 0.969
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0065 0.0594 0.164
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0101 0.1028 0.1028
Onchocerca volvulus Protein ultraspiracle homolog 0.003 0.0173 0.0954
Leishmania major mitochondrial DNA polymerase beta 0.0311 0.3549 1
Trichomonas vaginalis ATP synthase, putative 0.0033 0.0203 0.0553
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.003 0.0173 0.0602
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0101 0.1028 0.3584
Mycobacterium ulcerans DNA polymerase IV 0.0041 0.0296 0.1519
Loa Loa (eye worm) hypothetical protein 0.003 0.0173 0.0602
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.003 0.0173 0.0173
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Leishmania major cathepsin L-like protease 0.0066 0.0597 0.1649
Brugia malayi Papain family cysteine protease containing protein 0.0017 0.0014 0.0049
Loa Loa (eye worm) hypothetical protein 0.0156 0.1679 0.5855
Echinococcus granulosus cathepsin L cysteine proteinase 0.0017 0.0014 0.0049
Trypanosoma cruzi DNA polymerase kappa, putative 0.0041 0.0296 0.0798
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0592 0.3533
Brugia malayi Steroid receptor seven-up type 2 0.003 0.0173 0.0602
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0301 0.3429 1
Brugia malayi MH2 domain containing protein 0.0123 0.1286 0.4484
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0023 0.0085 0.3226
Leishmania major phosphopantetheinyl transferase-like protein 0.0023 0.0085 0.0202
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0002 0.0007
Loa Loa (eye worm) hypothetical protein 0.003 0.0173 0.0602
Brugia malayi Nuclear hormone receptor-like 1 0.003 0.0173 0.0602
Giardia lamblia DINP protein human, muc B family 0.0021 0.0058 0.0079
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0031 0.0889
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0053 0.0448 0.1227
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.003 0.0173 0.0173
Trypanosoma brucei DNA polymerase IV, putative 0.0041 0.0296 0.0824
Schistosoma mansoni retinoid-x-receptor (RXR) 0.003 0.0173 0.1032
Trypanosoma cruzi V-type proton ATPase subunit B, putative 0.0033 0.0203 0.0534
Loa Loa (eye worm) TAR-binding protein 0.0065 0.0592 0.2062
Loa Loa (eye worm) cysteine protease 0.0017 0.0014 0.0049
Brugia malayi Nuclear hormone receptor family member nhr-31 0.003 0.0173 0.0602
Onchocerca volvulus Bile acid receptor homolog 0.003 0.0173 0.0954
Brugia malayi photoreceptor-specific nuclear receptor 0.003 0.0173 0.0602
Loa Loa (eye worm) hypothetical protein 0.003 0.0173 0.0602
Brugia malayi Nuclear hormone receptor family member nhr-19 0.003 0.0173 0.0602
Loa Loa (eye worm) hypothetical protein 0.003 0.0173 0.0602
Echinococcus multilocularis survival motor neuron protein 1 0.0247 0.2779 0.2779
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0068 0.0621 0.1778
Mycobacterium tuberculosis Probable ATP synthase beta chain AtpD 0.0033 0.02 0.0968
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0262 0.0914
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0125 0.1308 0.456
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Brugia malayi Nuclear hormone receptor family member nhr-19 0.003 0.0173 0.0602
Mycobacterium tuberculosis Probable ATP synthase alpha chain AtpA 0.0033 0.02 0.0968
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.005 0.0413 0.1439
Schistosoma mansoni Tr4/Tr2 (homologue) 0.003 0.0173 0.1032
Brugia malayi Nuclear hormone receptor family member nhr-14 0.003 0.0173 0.0602
Trypanosoma brucei Vacuolar proton pump subunit B, putative 0.0033 0.0203 0.056
Plasmodium falciparum V-type proton ATPase subunit B 0.0033 0.0203 1
Echinococcus multilocularis dna polymerase kappa 0.0041 0.0296 0.0296
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0147 0.1578 0.4439
Trypanosoma cruzi major cysteine proteinase, putative 0.0052 0.0428 0.1171
Echinococcus multilocularis ATPase, H+ transporting, lysosomal accessory 0.0254 0.2868 0.2868
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.003 0.0173 0.0173
Mycobacterium ulcerans DNA polymerase IV 0.0041 0.0296 0.1519
Trypanosoma brucei DNA polymerase kappa, putative 0.0031 0.0177 0.0488
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0002 0.0007
Brugia malayi polk-prov protein 0.0031 0.0177 0.0618
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0031 0.0049
Schistosoma mansoni hypothetical protein 0.0125 0.1308 0.7812
Echinococcus granulosus ecdysone induced protein 78C 0.003 0.0173 0.0602
Echinococcus granulosus cathepsin l cysteine peptidase 0.0017 0.0014 0.0049
Echinococcus multilocularis ecdysone induced protein 78C 0.003 0.0173 0.0173
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Mycobacterium leprae PROBABLE ATP SYNTHASE ALPHA CHAIN ATPA 0.0033 0.02 0.0769
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0592 0.3533
Brugia malayi ATP synthase alpha chain, mitochondrial precursor, putative 0.0033 0.02 0.0697
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.003 0.0173 0.0173
Echinococcus multilocularis tar DNA binding protein 0.0065 0.0592 0.0592
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0301 0.3429 1
Loa Loa (eye worm) hypothetical protein 0.0254 0.2868 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.0592 0.2062
Schistosoma mansoni steroid hormone receptor ad4bp 0.003 0.0173 0.1032
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0301 0.3429 1
Echinococcus multilocularis ATP synthase subunit alpha, mitochondrial 0.0033 0.02 0.02
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.003 0.0173 0.0602
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0031 0.0107
Brugia malayi vacuolar ATP synthase subunit B 0.0033 0.0203 0.0707
Brugia malayi Cathepsin L-like precursor 0.0017 0.0014 0.0049
Schistosoma mansoni RAR-like nuclear receptor 0.003 0.0173 0.1032
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0065 0.0594 0.1698
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0002 0.0002
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0301 0.3429 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0311 0.3549 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0101 0.1028 0.614
Loa Loa (eye worm) steroid hormone receptor 0.003 0.0173 0.0602
Loa Loa (eye worm) hypothetical protein 0.003 0.0173 0.0602
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0031 0.0107
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0031 0.0889
Trypanosoma brucei ATP synthase F1, alpha subunit 0.0027 0.013 0.0356
Brugia malayi Melibiase family protein 0.0068 0.0621 0.2165
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0031 0.0107
Schistosoma mansoni hypothetical protein 0.0016 0.0002 0.0012
Plasmodium vivax ATP synthase alpha chain, putative 0.0033 0.02 0.9848
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0594 0.1663
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Trypanosoma cruzi DNA polymerase kappa, putative 0.0041 0.0296 0.0798
Leishmania major ATPase alpha subunit 0.0027 0.013 0.0329
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0101 0.1028 0.1028
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0594 0.164
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Brugia malayi Cathepsin L-like precursor 0.0017 0.0014 0.0049
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0301 0.3429 1
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0082 0.0798 0.2782
Loa Loa (eye worm) hypothetical protein 0.0082 0.0798 0.2782
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.003 0.0173 0.0602
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0023 0.0085 0.0704
Brugia malayi hypothetical protein 0.0254 0.2868 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.0424 0.1479
Onchocerca volvulus 0.005 0.0413 0.2395
Loa Loa (eye worm) hypothetical protein 0.0068 0.0621 0.2165
Trypanosoma brucei DNA polymerase kappa, putative 0.0021 0.0058 0.0151
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0031 0.0047
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0311 0.3549 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.003 0.0173 0.0602
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0147 0.1578 0.4424
Toxoplasma gondii exonuclease III APE 0.0019 0.0031 0.0166
Loa Loa (eye worm) fibroinase 0.0017 0.0014 0.0049
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.003 0.0173 0.1032
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0031 0.0049
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0147 0.1576 0.8843
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0101 0.1028 0.614
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0023 0.0085 0.0161
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0065 0.0594 0.207
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0031 0.0075
Echinococcus granulosus nuclear receptor 2DBD gamma 0.003 0.0173 0.0602
Schistosoma mansoni hypothetical protein 0.0016 0.0002 0.0012
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.003 0.0173 0.0602
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.003 0.0173 0.0602
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0065 0.0594 0.207
Trypanosoma cruzi cysteine peptidase, putative 0.0066 0.0597 0.1649
Loa Loa (eye worm) RNA binding protein 0.0065 0.0592 0.2062
Loa Loa (eye worm) hypothetical protein 0.003 0.0173 0.0602
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0002 0.0007
Loa Loa (eye worm) MH2 domain-containing protein 0.0123 0.1286 0.4484
Loa Loa (eye worm) hypothetical protein 0.0016 0.0002 0.0007
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0301 0.3429 1
Schistosoma mansoni thyroid hormone receptor 0.0155 0.1674 1
Trypanosoma cruzi cysteine peptidase, putative 0.0066 0.0597 0.1649
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.003 0.0173 0.1032
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0041 0.0296 0.0827
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0592 0.3533
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.0424 0.1479
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0592 0.3533
Treponema pallidum V-type ATP synthase subunit B 0.0033 0.0203 0.0506
Schistosoma mansoni hypothetical protein 0.0016 0.0002 0.0012
Schistosoma mansoni hypothetical protein 0.005 0.0413 0.2466
Echinococcus granulosus L aminoadipate semialdehyde 0.0082 0.0798 0.2782
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0031 0.0047
Wolbachia endosymbiont of Brugia malayi ATP synthase F0F1 subunit alpha 0.0033 0.02 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0147 0.1578 0.4424
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0301 0.3429 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.003 0.0173 0.0602
Echinococcus granulosus cathepsin l1 0.0017 0.0014 0.0049
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.003 0.0173 0.0602
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0311 0.3549 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0301 0.3429 1
Trypanosoma cruzi DNA polymerase kappa, putative 0.0041 0.0296 0.0798
Brugia malayi Cathepsin L-like precursor 0.0017 0.0014 0.0049
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0125 0.1308 0.1308
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0017 0.0014 0.0049
Leishmania major ATPase alpha subunit 0.0027 0.013 0.0329
Schistosoma mansoni ATP synthase subunit beta vacuolar 0.0033 0.0203 0.1211
Trichomonas vaginalis ATP synthase alpha subunit mitochondrial, putative 0.0033 0.0203 0.0553
Loa Loa (eye worm) hypothetical protein 0.0017 0.0014 0.0049
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.003 0.0173 0.0602
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0031 0.0047
Loa Loa (eye worm) hypothetical protein 0.0051 0.0424 0.1479
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.0424 0.1479
Brugia malayi hypothetical protein 0.0247 0.2779 0.969
Trypanosoma cruzi cysteine peptidase, putative 0.0066 0.0597 0.1649
Mycobacterium tuberculosis Conserved hypothetical protein 0.0164 0.1778 1
Trypanosoma cruzi Vacuolar proton pump subunit B, putative 0.0033 0.0203 0.0534
Trichomonas vaginalis DNA polymerase eta, putative 0.0041 0.0296 0.0827
Loa Loa (eye worm) hypothetical protein 0.003 0.0173 0.0602
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0068 0.0621 0.371
Brugia malayi Nuclear hormone receptor family member nhr-1 0.003 0.0173 0.0602
Echinococcus multilocularis cathepsin L cysteine protease 0.0017 0.0014 0.0014
Echinococcus granulosus ATPase H transporting lysosomal accessory 0.0254 0.2868 1
Brugia malayi RNA binding protein 0.0065 0.0592 0.2062
Trypanosoma cruzi cruzipain precursor, putative 0.0066 0.0597 0.1649
Trypanosoma cruzi DNA polymerase kappa, putative 0.0041 0.0296 0.0798
Plasmodium falciparum ATP synthase F1, alpha subunit 0.0033 0.02 0.9848
Onchocerca volvulus 0.0156 0.1679 1
Leishmania major DNA polymerase kappa, putative 0.0021 0.0058 0.0124
Brugia malayi steroid hormone receptor 0.003 0.0173 0.0602
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0031 0.0031
Mycobacterium ulcerans hypothetical protein 0.0164 0.1778 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0031 0.0049
Brugia malayi Nuclear hormone receptor family member nhr-40 0.003 0.0173 0.0602
Loa Loa (eye worm) hypothetical protein 0.003 0.0173 0.0602
Treponema pallidum fructose-bisphosphate aldolase 0.0301 0.3429 1
Leishmania major vacuolar ATP synthase subunit b, putative 0.0033 0.0203 0.0534
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0592 0.3533
Trypanosoma brucei unspecified product 0.0034 0.0218 0.0602
Giardia lamblia Vacuolar ATP synthase subunit B 0.0033 0.0203 0.0506
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.003 0.0173 0.0173
Entamoeba histolytica hypothetical protein 0.0023 0.0085 0.0209
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Brugia malayi nuclear receptor NHR-88 0.003 0.0173 0.0602
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.003 0.0173 0.0954
Brugia malayi Nuclear hormone receptor family member nhr-25 0.003 0.0173 0.0602
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0229 0.0798
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0023 0.0085 0.0312
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0262 0.0262
Echinococcus multilocularis thyroid hormone receptor alpha 0.0155 0.1674 0.1674
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0023 0.0085 0.0704
Echinococcus multilocularis cathepsin L cysteine protease 0.0017 0.0014 0.0014
Toxoplasma gondii melibiase subfamily protein 0.0101 0.1028 1
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0082 0.0798 0.4767
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0101 0.1028 0.614
Chlamydia trachomatis V-type ATP synthase subunit B 0.0033 0.0203 1
Trypanosoma brucei hypothetical protein, conserved 0.0023 0.0085 0.0229
Onchocerca volvulus ATP synthase subunit alpha, mitochondrial homolog 0.0033 0.02 0.1117
Trypanosoma brucei DNA polymerase IV, putative 0.0034 0.0218 0.0602
Brugia malayi TAR-binding protein 0.0065 0.0592 0.2062
Echinococcus granulosus nuclear receptor 2DBD gamma 0.003 0.0173 0.0602
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0101 0.1028 0.614
Schistosoma mansoni cathepsin F (C01 family) 0.0017 0.0014 0.0084
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0002 0.0007
Brugia malayi Nuclear hormone receptor family member nhr-49 0.003 0.0173 0.0602
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0044 0.0333 0.0927
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0002 0.0007
Onchocerca volvulus 0.003 0.0173 0.0954
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0333 0.0902
Schistosoma mansoni retinoic acid receptor RXR 0.003 0.0173 0.1032
Echinococcus multilocularis cysteine protease 0.0017 0.0014 0.0014
Brugia malayi Cathepsin L-like precursor 0.0017 0.0014 0.0049
Loa Loa (eye worm) transcription factor SMAD2 0.0123 0.1286 0.4484
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0065 0.0594 0.0594
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0065 0.0594 0.207
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0017 0.0014 0.0014
Echinococcus granulosus survival motor neuron protein 1 0.0247 0.2779 0.969
Trypanosoma brucei DNA polymerase IV, putative 0.0041 0.0296 0.0824
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0065 0.0594 0.3546
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0044 0.0333 0.0902
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.003 0.0173 0.1032
Loa Loa (eye worm) ctsf protein 0.0017 0.0014 0.0049
Leishmania major cathepsin L-like protease 0.0066 0.0597 0.1649
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0065 0.0594 0.164
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0147 0.1576 1
Leishmania major cathepsin L-like protease 0.0066 0.0597 0.1649
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0021 0.0058 0.0124
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0301 0.3429 1
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0147 0.1576 0.8843
Echinococcus multilocularis L aminoadipate semialdehyde 0.0082 0.0798 0.0798
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0021 0.0058 0.0155
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.003 0.0173 0.0173
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0023 0.0085 0.0312
Echinococcus multilocularis GPCR, family 2 0.0016 0.0002 0.0002
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.003 0.0173 0.0602
Brugia malayi Nuclear hormone receptor family member nhr-25 0.003 0.0173 0.0602
Entamoeba histolytica V-type ATPase, B subunit, putative 0.0033 0.0203 0.0553
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.006 0.0528 0.1455
Echinococcus multilocularis vacuolar ATP synthase subunit b 0.0033 0.0203 0.0203
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.003 0.0173 0.0602
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0017 0.0014 0.0049
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Schistosoma mansoni survival motor neuron protein 0.005 0.0413 0.2466
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0002 0.0002
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0023 0.0085 0.3779
Schistosoma mansoni nuclear hormone receptor 0.003 0.0173 0.1032
Brugia malayi Nuclear hormone receptor family member nhr-41 0.003 0.0173 0.0602
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0017 0.0014 0.0014
Trypanosoma brucei DNA polymerase kappa, putative 0.0031 0.0177 0.0488
Echinococcus multilocularis cysteine protease 0.0017 0.0014 0.0014
Echinococcus granulosus ATP synthase subunit alpha mitochondrial 0.0033 0.02 0.0697
Loa Loa (eye worm) hypothetical protein 0.0031 0.0177 0.0618
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0301 0.3429 1
Brugia malayi Cathepsin L-like precursor 0.0017 0.0014 0.0049
Trypanosoma brucei DNA polymerase kappa, putative 0.0041 0.0296 0.0824
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.003 0.0173 0.0602
Schistosoma mansoni hypothetical protein 0.0016 0.0002 0.0012
Brugia malayi nuclear hormone receptor 0.003 0.0173 0.0602
Echinococcus multilocularis FTZ F1 alpha 0.003 0.0173 0.0173
Loa Loa (eye worm) vacuolar ATP synthase subunit B 0.0033 0.0203 0.0707
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0333 0.0902
Trypanosoma brucei ATP synthase F1, alpha subunit 0.0027 0.013 0.0356
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0023 0.0085 0.0312
Giardia lamblia Fructose-bisphosphate aldolase 0.0301 0.3429 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0066 0.0597 0.1672
Schistosoma mansoni thyroid hormone receptor 0.0155 0.1674 1
Schistosoma mansoni ATP synthase alpha subunit mitochondrial 0.0033 0.02 0.1194
Plasmodium vivax vacuolar ATP synthase subunit b, putative 0.0033 0.0203 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.003 0.0173 0.1032
Toxoplasma gondii vacuolar ATP synthase subunit b, putative 0.0033 0.0203 0.1862
Mycobacterium leprae PROBABLE ATP SYNTHASE BETA CHAIN ATPD 0.0033 0.02 0.0769
Schistosoma mansoni ap endonuclease 0.0019 0.0031 0.0184
Echinococcus granulosus vacuolar ATP synthase subunit b 0.0033 0.0203 0.0707
Brugia malayi hypothetical protein 0.0156 0.1679 0.5855
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.003 0.0173 0.0602
Echinococcus granulosus tar DNA binding protein 0.0065 0.0592 0.2062
Brugia malayi Cathepsin L-like precursor 0.0017 0.0014 0.0049
Treponema pallidum V-type ATP synthase subunit B 0.0033 0.0203 0.0506
Echinococcus granulosus dna polymerase kappa 0.0041 0.0296 0.1033
Onchocerca volvulus 0.0082 0.0798 0.4709
Loa Loa (eye worm) hypothetical protein 0.0035 0.0229 0.0798
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0068 0.0621 0.371
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.0592 0.2062
Mycobacterium ulcerans F0F1 ATP synthase subunit alpha 0.0033 0.02 0.0968
Echinococcus granulosus GPCR family 2 0.0016 0.0002 0.0007

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 0.0000003 M Antitumor activity against L1210 cells ChEMBL. 6276541
IC50 (functional) = 0.0000005 M Antitumor activity against HeLa cells ChEMBL. 6276541
Inhibition (functional) = 5 % Inhibition against L1210 cells growth at 8*10e-7 M. ChEMBL. 6276541

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 6276541
Mus musculus ChEMBL23 6276541

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

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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