Detailed information for compound 34889

Basic information

Technical information
  • TDR Targets ID: 34889
  • Name: 2-[6-amino-2-(2-thiophen-2-ylethoxy)purin-9-y l]-5-(hydroxymethyl)oxolane-3,4-diol
  • MW: 393.418 | Formula: C16H19N5O5S
  • H donors: 4 H acceptors: 6 LogP: 0.07 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCC1OC(C(C1O)O)n1cnc2c1nc(OCCc1cccs1)nc2N
  • InChi: 1S/C16H19N5O5S/c17-13-10-14(20-16(19-13)25-4-3-8-2-1-5-27-8)21(7-18-10)15-12(24)11(23)9(6-22)26-15/h1-2,5,7,9,11-12,15,22-24H,3-4,6H2,(H2,17,19,20)
  • InChiKey: BVOKQKZIUWGDTK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[6-amino-2-[2-(2-thienyl)ethoxy]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • 2-[6-amino-2-[2-(2-thienyl)ethoxy]-9-purinyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • 2-[6-azanyl-2-(2-thiophen-2-ylethoxy)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • 2-[6-amino-2-[2-(2-thienyl)ethoxy]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol

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
Brugia malayi ecdysone receptor 0.0053 0.0218 0.0298
Trypanosoma cruzi trypanothione reductase, putative 0.0052 0.0213 0.0287
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0133 0.0727 0.9468
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0174 0.0174
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0089 0.0089
Echinococcus granulosus thyroid hormone receptor alpha 0.0053 0.0218 0.0218
Plasmodium vivax glutathione reductase, putative 0.0052 0.0213 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0113 0.06 0.0818
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0174 0.0181
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.1166 0.7333 1
Giardia lamblia Fructose-bisphosphate aldolase 0.0285 0.1701 1
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0133 0.0178
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0041 0.0052
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0113 0.06 0.06
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0041 0.1506
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0052 0.0213 0.2744
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0111 0.0111
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0113 0.06 0.0818
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0113 0.06 0.0624
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0113 0.06 0.06
Schistosoma mansoni RAR-like nuclear receptor 0.0113 0.06 0.06
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0113 0.06 0.06
Loa Loa (eye worm) hypothetical protein 0.0026 0.0041 0.0056
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0053 0.0218 0.0218
Plasmodium falciparum flap endonuclease 1 0.0026 0.0046 0.1775
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0046 0.017 0.017
Brugia malayi Nuclear hormone receptor E75 0.0053 0.0218 0.0298
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0041 0.1506
Entamoeba histolytica hypothetical protein 0.0037 0.0111 0.0148
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0053 0.0218 0.0298
Trichomonas vaginalis maltase-glucoamylase, putative 0.004 0.0133 0.0769
Loa Loa (eye worm) hypothetical protein 0.006 0.0259 0.0353
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.001 0.001
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0288 0.03
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0113 0.06 0.06
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0288 0.0393
Echinococcus multilocularis ecdysone induced protein 78C 0.0113 0.06 0.0624
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.0133 0.0769
Echinococcus granulosus Nuclear hormone receptor HR96 0.0053 0.0218 0.0218
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0288 0.0393
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0113 0.06 0.0624
Schistosoma mansoni ap endonuclease 0.0021 0.001 0.001
Schistosoma mansoni hypothetical protein 0.0172 0.0977 0.0977
Loa Loa (eye worm) hypothetical protein 0.0113 0.06 0.0818
Brugia malayi Flap endonuclease-1 0.0026 0.0046 0.0063
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0111 0.0115
Onchocerca volvulus 0.0034 0.0094 0.0607
Toxoplasma gondii thioredoxin reductase 0.0052 0.0213 1
Brugia malayi nuclear receptor RXR 0.006 0.0259 0.0353
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1166 0.7333 1
Brugia malayi Thioredoxin reductase 0.0052 0.0213 0.029
Schistosoma mansoni alpha glucosidase 0.004 0.0133 0.0133
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0288 0.0288
Schistosoma mansoni chromobox protein 0.0077 0.0371 0.0371
Schistosoma mansoni thyroid hormone receptor 0.0113 0.06 0.06
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.1701 1
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.006 0.0259 0.0269
Echinococcus multilocularis geminin 0.0172 0.0977 0.1015
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0113 0.06 0.06
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.006 0.0259 0.0259
Echinococcus multilocularis chromobox protein 1 0.0077 0.0371 0.0386
Brugia malayi Glycosyl hydrolases family 31 protein 0.018 0.103 0.1405
Loa Loa (eye worm) hypothetical protein 0.0113 0.06 0.0818
Trypanosoma brucei glucosidase, putative 0.004 0.0133 0.0178
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.002 0.0003 0.0003
Brugia malayi nuclear hormone receptor family member odr-7 0.0053 0.0218 0.0298
Echinococcus granulosus flap endonuclease 1 0.0026 0.0046 0.0046
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0113 0.06 0.0818
Schistosoma mansoni terminal deoxycytidyl transferase 0.002 0.0003 0.0003
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.012 0.0642 0.8353
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0113 0.06 0.0818
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0113 0.06 0.0818
Schistosoma mansoni coup transcription factor 0.0113 0.06 0.06
Schistosoma mansoni nuclear receptor 0.0053 0.0218 0.0218
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.002 0.0003 0.0003
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0113 0.06 0.06
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0113 0.06 0.0624
Giardia lamblia Flap structure-specific endonuclease 0.0026 0.0046 0.0258
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0047 0.0175 0.1126
Brugia malayi hypothetical protein 0.0026 0.0041 0.0056
Echinococcus granulosus transcription factor Dp 1 0.0675 0.4193 0.4193
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0041 0.1506
Brugia malayi photoreceptor-specific nuclear receptor 0.0113 0.06 0.0818
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.001 0.0014
Mycobacterium tuberculosis Probable reductase 0.012 0.0642 0.8353
Schistosoma mansoni nuclear hormone receptor 0.0053 0.0218 0.0218
Onchocerca volvulus 0.0046 0.017 0.1091
Trypanosoma cruzi DNA polymerase eta, putative 0.0032 0.0081 0.0108
Echinococcus multilocularis lysosomal alpha glucosidase 0.018 0.103 0.1071
Brugia malayi ImpB/MucB/SamB family protein 0.0045 0.0168 0.0229
Echinococcus granulosus tar DNA binding protein 0.0064 0.0288 0.0288
Loa Loa (eye worm) nuclear hormone receptor 0.0053 0.0218 0.0298
Loa Loa (eye worm) thioredoxin reductase 0.0052 0.0213 0.029
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0026 0.0046 0.006
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0231 0.1353 0.1845
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.1166 0.7333 0.7624
Echinococcus multilocularis dna polymerase eta 0.0045 0.0168 0.0174
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0113 0.06 0.0818
Brugia malayi steroid hormone receptor 0.0113 0.06 0.0818
Brugia malayi tailless protein 0.0053 0.0218 0.0298
Schistosoma mansoni ap endonuclease 0.0021 0.001 0.001
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0053 0.0218 0.0218
Echinococcus granulosus chromobox protein 1 0.0077 0.0371 0.0371
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0139 0.0768 1
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.004 0.0133 0.607
Loa Loa (eye worm) hypothetical protein 0.006 0.0259 0.0353
Schistosoma mansoni alpha-glucosidase 0.0155 0.087 0.087
Leishmania major hypothetical protein, conserved 0.0026 0.0041 0.0052
Brugia malayi Glycosyl hydrolases family 31 protein 0.004 0.0133 0.0182
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0021 0.001 0.0011
Schistosoma mansoni zinc finger protein 0.0053 0.0218 0.0218
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0041 0.0052
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Trichomonas vaginalis chromobox protein, putative 0.0047 0.0175 0.1017
Loa Loa (eye worm) hypothetical protein 0.0113 0.06 0.0818
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Loa Loa (eye worm) hypothetical protein 0.006 0.0259 0.0353
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.1701 1
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.1166 0.7333 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0113 0.06 0.06
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0285 0.1701 0.2317
Schistosoma mansoni nuclear hormone receptor 0.0113 0.06 0.06
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0053 0.0218 0.0227
Brugia malayi Nuclear hormone receptor-like 1 0.006 0.0259 0.0353
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0113 0.06 0.0818
Schistosoma mansoni retinoid-x-receptor (RXR) 0.006 0.0259 0.0259
Echinococcus multilocularis thioredoxin glutathione reductase 0.0052 0.0213 0.0221
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0053 0.0218 0.0227
Trypanosoma brucei trypanothione reductase 0.0052 0.0213 0.0287
Loa Loa (eye worm) hypothetical protein 0.006 0.0259 0.0353
Schistosoma mansoni nuclear receptor 0.0053 0.0218 0.0218
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1166 0.7333 1
Brugia malayi Nuclear hormone receptor-like 1 0.0113 0.06 0.0818
Treponema pallidum fructose-bisphosphate aldolase 0.0285 0.1701 1
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.1166 0.7333 0.7333
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0041 0.0052
Brugia malayi nuclear receptor NHR-67 0.0053 0.0218 0.0298
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0021 0.001 0.0103
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0113 0.06 0.3855
Leishmania major trypanothione reductase 0.0052 0.0213 0.0287
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0026 0.0046 0.006
Trichomonas vaginalis conserved hypothetical protein 0.0043 0.0154 0.0893
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0089 0.0093
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0111 0.0111
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0113 0.06 0.0624
Onchocerca volvulus Protein ultraspiracle homolog 0.0113 0.06 0.3855
Brugia malayi nuclear hormone receptor 0.0113 0.06 0.0818
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0174 0.0174
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0089 0.0089
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.0133 0.0178
Trichomonas vaginalis conserved hypothetical protein 0.0031 0.0073 0.0417
Trichomonas vaginalis chromobox protein, putative 0.0047 0.0175 0.1017
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.002 0.0003 0.0004
Brugia malayi chromobox protein homolog 3 0.0043 0.0154 0.021
Trichomonas vaginalis chromobox protein, putative 0.0077 0.0371 0.2171
Leishmania major alpha glucosidase II subunit, putative 0.004 0.0133 0.0178
Echinococcus multilocularis lysosomal alpha glucosidase 0.018 0.103 0.1071
Entamoeba histolytica hypothetical protein 0.0037 0.0111 0.0148
Mycobacterium tuberculosis Putative ferredoxin reductase 0.012 0.0642 0.8353
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.1166 0.7333 1
Brugia malayi nuclear receptor NHR-88 0.0113 0.06 0.0818
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0288 0.0288
Onchocerca volvulus Bile acid receptor homolog 0.0113 0.06 0.3855
Echinococcus multilocularis nuclear receptor nhr 48 0.0053 0.0218 0.0227
Schistosoma mansoni retinoic acid receptor RXR 0.1584 1 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.1701 1
Loa Loa (eye worm) flap endonuclease-1 0.0026 0.0046 0.0063
Plasmodium vivax flap endonuclease 1, putative 0.0026 0.0046 0.1775
Echinococcus granulosus lysosomal alpha glucosidase 0.018 0.103 0.103
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0288 0.0288
Loa Loa (eye worm) heterochromatin protein 1 0.0077 0.0371 0.0506
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0133 0.0727 0.9468
Loa Loa (eye worm) nuclear receptor NHR-67 0.0053 0.0218 0.0298
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0113 0.06 0.06
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0113 0.06 0.0818
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0032 0.0081 0.3514
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0133 0.0178
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0033 0.0089 0.0093
Loa Loa (eye worm) hypothetical protein 0.006 0.0259 0.0353
Loa Loa (eye worm) hypothetical protein 0.0033 0.0089 0.0121
Loa Loa (eye worm) hypothetical protein 0.0045 0.0168 0.0229
Brugia malayi hypothetical protein 0.0037 0.0111 0.0151
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0113 0.06 0.0818
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0089 0.3887
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.1524 0.9618 1
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0026 0.0046 0.006
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0113 0.06 0.06
Echinococcus granulosus dna polymerase kappa 0.002 0.0003 0.0003
Echinococcus granulosus geminin 0.0172 0.0977 0.0977
Echinococcus granulosus chromobox protein 1 0.0077 0.0371 0.0371
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.018 0.103 0.1405
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0021 0.001 0.0011
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0113 0.06 0.0818
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.006 0.0259 0.0353
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0053 0.0218 0.1402
Echinococcus granulosus histone lysine methyltransferase setb 0.0033 0.0089 0.0089
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.1701 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0113 0.06 0.0818
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.1166 0.7333 1
Loa Loa (eye worm) glutathione reductase 0.0052 0.0213 0.029
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0174 0.0174
Echinococcus multilocularis dna polymerase kappa 0.002 0.0003 0.0003
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0174 0.0174
Brugia malayi nuclear hormone receptor 0.0053 0.0218 0.0298
Brugia malayi glutathione reductase 0.0052 0.0213 0.029
Trypanosoma brucei DNA polymerase eta, putative 0.0045 0.0168 0.0225
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0053 0.0218 0.1402
Plasmodium falciparum glutathione reductase 0.0052 0.0213 1
Plasmodium vivax thioredoxin reductase, putative 0.0052 0.0213 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0053 0.0218 0.0218
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0021 0.001 0.0011
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0113 0.06 0.06
Trichomonas vaginalis set domain proteins, putative 0.0263 0.1557 0.9151
Plasmodium vivax SET domain protein, putative 0.0033 0.0089 0.3887
Loa Loa (eye worm) DR-78 0.0053 0.0218 0.0298
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0133 0.0769
Loa Loa (eye worm) hypothetical protein 0.0113 0.06 0.0818
Entamoeba histolytica hypothetical protein 0.0037 0.0111 0.0148
Loa Loa (eye worm) RNA binding protein 0.0064 0.0288 0.0393
Brugia malayi Pre-SET motif family protein 0.0231 0.1353 0.1845
Brugia malayi ecdysteroid receptor 0.0113 0.06 0.0818
Brugia malayi RNA binding protein 0.0064 0.0288 0.0393
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.1701 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0113 0.06 0.0818
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0026 0.0046 0.1775
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0113 0.06 0.06
Echinococcus multilocularis FTZ F1 alpha 0.0113 0.06 0.0624
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.002 0.0003 0.0003
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0021 0.001 0.0011
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0133 0.0769
Echinococcus granulosus neutral alpha glucosidase AB 0.004 0.0133 0.0133
Echinococcus granulosus dna polymerase eta 0.0045 0.0168 0.0168
Trichomonas vaginalis conserved hypothetical protein 0.0031 0.0073 0.0417
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0174 0.0181
Onchocerca volvulus 0.0053 0.0218 0.1402
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0288 0.0288
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0139 0.0768 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0021 0.001 0.0011
Brugia malayi conserved hypotetical protein 0.0053 0.0218 0.0298
Trichomonas vaginalis conserved hypothetical protein 0.0043 0.0154 0.0893
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0053 0.0218 0.0218
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.001 0.0011
Schistosoma mansoni nuclear receptor nhr-48 0.0053 0.0218 0.0218
Trichomonas vaginalis chromobox protein, putative 0.0077 0.0371 0.2171
Schistosoma mansoni flap endonuclease-1 0.0024 0.003 0.003
Plasmodium falciparum thioredoxin reductase 0.0052 0.0213 1
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0133 0.0769
Echinococcus multilocularis chromobox protein 1 0.0077 0.0371 0.0386
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0113 0.06 0.0624
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0041 0.1506
Loa Loa (eye worm) hypothetical protein 0.0113 0.06 0.0818
Schistosoma mansoni thyroid hormone receptor 0.0113 0.06 0.06
Echinococcus multilocularis microtubule associated protein 2 0.0765 0.477 0.4959
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0053 0.0218 0.0227
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.012 0.0642 0.8353
Echinococcus granulosus ecdysone induced protein 78C 0.0113 0.06 0.06
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.001 0.0046
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.0081 0.0081
Schistosoma mansoni alpha-glucosidase 0.0155 0.087 0.087
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0053 0.0218 0.0227
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0021 0.001 0.5
Echinococcus granulosus nuclear receptor nhr 48 0.0053 0.0218 0.0218
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0113 0.06 0.0818
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.1701 1
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.1166 0.7333 1
Brugia malayi TAR-binding protein 0.0064 0.0288 0.0393
Schistosoma mansoni hypothetical protein 0.0037 0.0111 0.0111
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0021 0.001 0.0046
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0089 0.0089
Loa Loa (eye worm) hypothetical protein 0.0113 0.06 0.0818
Leishmania major DNA polymerase eta, putative 0.0032 0.0081 0.0108
Entamoeba histolytica Flap nuclease, putative 0.0026 0.0046 0.006
Leishmania major DNA polymerase eta, putative 0.0045 0.0168 0.0225
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0113 0.06 0.0818
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0021 0.001 0.0103
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0043 0.0154 0.0991
Brugia malayi orphan nuclear receptor NR2E1 0.0053 0.0218 0.0298
Entamoeba histolytica hypothetical protein 0.0037 0.0111 0.0148
Echinococcus multilocularis neutral alpha glucosidase AB 0.004 0.0133 0.0138
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.001 0.0046
Loa Loa (eye worm) hypothetical protein 0.0034 0.0094 0.0129
Trypanosoma cruzi DNA polymerase eta, putative 0.0045 0.0168 0.0225
Schistosoma mansoni chromobox protein 0.0077 0.0371 0.0371
Brugia malayi hypothetical protein 0.006 0.0259 0.0353
Schistosoma mansoni nuclear hormone receptor 0.0053 0.0218 0.0218
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Brugia malayi hypothetical protein 0.0053 0.0218 0.0298
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0113 0.06 0.0818
Loa Loa (eye worm) hypothetical protein 0.0113 0.06 0.0818
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0113 0.06 0.0624
Echinococcus multilocularis flap endonuclease 1 0.0026 0.0046 0.0048
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0174 0.0174
Echinococcus multilocularis thyroid hormone receptor alpha 0.0113 0.06 0.0624
Echinococcus granulosus FTZ F1 alpha 0.0113 0.06 0.06
Onchocerca volvulus 0.0263 0.1557 1
Brugia malayi Pre-SET motif family protein 0.0033 0.0089 0.0121
Brugia malayi hypothetical protein 0.0053 0.0218 0.0298
Brugia malayi nuclear hormone receptor family member nhr-6 0.0053 0.0218 0.0298
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Brugia malayi hypothetical protein 0.006 0.0259 0.0353
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.004 0.0133 0.0769
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0113 0.06 0.0818
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.012 0.0642 0.8353
Brugia malayi Heterochromatin protein 1 0.0077 0.0371 0.0506
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.1701 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.004 0.0133 0.0178
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0113 0.06 0.0818
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0288 0.0393
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0113 0.06 0.0818
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0113 0.06 0.06
Loa Loa (eye worm) hypothetical protein 0.0113 0.06 0.0818
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0133 0.0769
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.1166 0.7333 0.7333
Echinococcus granulosus microtubule associated protein 2 0.0765 0.477 0.477
Trichomonas vaginalis flap endonuclease-1, putative 0.0026 0.0046 0.0258
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0285 0.1701 1
Trichomonas vaginalis sucrase-isomaltase, putative 0.004 0.0133 0.0769
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.006 0.0259 0.0259
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0285 0.1701 0.2317
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0133 0.0727 0.6769
Onchocerca volvulus 0.0104 0.0544 0.3495
Loa Loa (eye worm) steroid hormone receptor 0.0113 0.06 0.0818
Mycobacterium tuberculosis Probable oxidoreductase 0.0133 0.0727 0.9468
Schistosoma mansoni hypothetical protein 0.0172 0.0977 0.0977
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0139 0.0768 1
Echinococcus multilocularis transcription factor Dp 1 0.0675 0.4193 0.4359
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0113 0.06 0.0818
Echinococcus granulosus Nuclear hormone receptor HR96 0.0053 0.0218 0.0218
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.004 0.0133 0.0182
Onchocerca volvulus 0.0113 0.06 0.3855
Brugia malayi Nuclear hormone receptor E75 0.0053 0.0218 0.0298
Schistosoma mansoni microtubule-associated protein tau 0.0765 0.477 0.477
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.001 0.0014
Brugia malayi nuclear receptor NHR-88 0.0053 0.0218 0.0298
Schistosoma mansoni DNA polymerase eta 0.0045 0.0168 0.0168
Mycobacterium tuberculosis Probable dehydrogenase 0.012 0.0642 0.8353
Echinococcus granulosus thioredoxin glutathione reductase 0.0052 0.0213 0.0213
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0113 0.06 0.0818
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0113 0.06 0.06
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0174 0.0237
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0003 0.0004
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0053 0.0218 0.0298
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0174 0.0237
Onchocerca volvulus 0.0053 0.0218 0.1402
Loa Loa (eye worm) hypothetical protein 0.0053 0.0218 0.0298
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0288 0.0288
Brugia malayi Nuclear hormone receptor-like 1 0.006 0.0259 0.0353
Loa Loa (eye worm) hypothetical protein 0.0043 0.0154 0.021
Trichomonas vaginalis alpha-glucosidase, putative 0.004 0.0133 0.0769
Brugia malayi nuclear receptor RXR 0.0053 0.0218 0.0298
Brugia malayi Steroid receptor seven-up type 2 0.0113 0.06 0.0818

Activities

Activity type Activity value Assay description Source Reference
-Log EC50 (functional) = 4.93 Effective concentration of the compound required for prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation ChEMBL. 2016708
-Log EC50 (functional) = 8.43 Concentration of the compound required for coronary arteries vasodilation at the Adenosine A2 receptor in langendorff guinea pig heart preparation ChEMBL. 2016708
Ratio (functional) = 3500 Ratio of stim-QRS (conduction block) to EC50 for vasodilation of coronary arteries ChEMBL. 2016708

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

Bibliographic References

1 literature reference was collected for this gene.

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