Detailed information for compound 146097

Basic information

Technical information
  • TDR Targets ID: 146097
  • Name: 3-bromo-5-hydroxy-4-methoxybenzaldehyde
  • MW: 231.043 | Formula: C8H7BrO3
  • H donors: 1 H acceptors: 2 LogP: 1.69 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=Cc1cc(O)c(c(c1)Br)OC
  • InChi: 1S/C8H7BrO3/c1-12-8-6(9)2-5(4-10)3-7(8)11/h2-4,11H,1H3
  • InChiKey: XUMZJGFRKABSNY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-bromo-5-hydroxy-4-methoxy-benzaldehyde

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
Loa Loa (eye worm) hypothetical protein 0.022 0.0546 0.4943
Plasmodium falciparum LCCL domain-containing protein 0.0018 0.0027 0.0059
Onchocerca volvulus 0.003 0.0056 0.0268
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0028 0.0028
Echinococcus multilocularis lipoxygenase domain containing protein 0.0018 0.0027 0.0027
Brugia malayi dUTP diphosphatase 0.0123 0.0298 0.2677
Echinococcus multilocularis thyroid hormone receptor alpha 0.022 0.0546 0.0546
Trypanosoma brucei DNA polymerase eta, putative 0.0019 0.0028 0.0103
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.022 0.0546 0.545
Brugia malayi Nuclear hormone receptor family member nhr-3 0.022 0.0546 0.4944
Trichomonas vaginalis thymidine kinase, putative 0.0577 0.1468 1
Onchocerca volvulus 0.0104 0.0247 0.2049
Schistosoma mansoni zinc finger protein 0.0104 0.0247 0.2462
Onchocerca volvulus Phospholipase A2 homolog 0.0435 0.1101 1
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Brugia malayi Steroid receptor seven-up type 2 0.022 0.0546 0.4944
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Entamoeba histolytica hypothetical protein 0.0081 0.0187 0.1126
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.022 0.0546 0.4944
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0056 0.084
Trichomonas vaginalis deoxyuridine 5'-triphosphate nucleotidohydrolase, putative 0.0123 0.0298 0.1891
Toxoplasma gondii histone lysine methyltransferase SET1 0.0054 0.0118 0.2536
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.0063 0.0141 0.0807
Giardia lamblia DINP protein human, muc B family 0.0019 0.0028 0.0021
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.022 0.0546 0.545
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.022 0.0546 0.0546
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase, mitochondrial precursor, putative 0.0123 0.0298 0.1891
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0028 0.0028
Treponema pallidum deoxyuridine 5'-triphosphate nucleotidohydrolase (dut) 0.0123 0.0298 0.3982
Trypanosoma brucei thymidine kinase 0.0577 0.1468 1
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0051 0.0051
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0004 0.0004
Brugia malayi conserved hypotetical protein 0.0104 0.0247 0.2213
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.022 0.0546 0.0546
Onchocerca volvulus 0.023 0.0573 0.5089
Brugia malayi hypothetical protein 0.0018 0.0027 0.0207
Wolbachia endosymbiont of Brugia malayi dihydroorotate dehydrogenase 2 0.0161 0.0394 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.022 0.0546 0.545
Entamoeba histolytica hypothetical protein 0.0123 0.0298 0.1891
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Brugia malayi Cytochrome P450 family protein 0.0042 0.0088 0.0766
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0104 0.0247 0.0247
Loa Loa (eye worm) dUTP diphosphatase 0.0123 0.0298 0.2675
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.0028 0.0021
Brugia malayi Nuclear hormone receptor E75 0.0104 0.0247 0.2213
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0063 0.0141 0.0141
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0056 0.0056
Leishmania major DNA polymerase kappa, putative 0.0019 0.0028 0.0021
Brugia malayi Nuclear hormone receptor family member nhr-19 0.022 0.0546 0.4944
Entamoeba histolytica hypothetical protein 0.0123 0.0298 0.1891
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0104 0.0247 0.2049
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0025 0.0187
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0161 0.0394 0.3553
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.022 0.0546 0.0546
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.022 0.0546 0.4837
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase, putative 0.0043 0.009 0.0452
Schistosoma mansoni DNA polymerase eta 0.0019 0.0028 0.0276
Brugia malayi Nuclear hormone receptor family member nhr-25 0.022 0.0546 0.4944
Echinococcus granulosus lipoxygenase domain containing protein 0.0018 0.0027 0.0027
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.022 0.0546 0.0546
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0063 0.0141 0.0141
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.022 0.0546 0.4944
Schistosoma mansoni rab6-interacting 0.0018 0.0027 0.0267
Brugia malayi Nuclear hormone receptor E75 0.0104 0.0247 0.2213
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0004 0.0004
Plasmodium falciparum dihydroorotate dehydrogenase 0.0161 0.0394 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0025 0.0185
Brugia malayi Nuclear hormone receptor family member nhr-19 0.022 0.0546 0.4944
Brugia malayi Doublecortin family protein 0.0018 0.0027 0.0207
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0028 0.0021
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein 0.0123 0.0298 0.1891
Wolbachia endosymbiont of Brugia malayi dUTPase 0.0123 0.0298 0.7397
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Loa Loa (eye worm) hypothetical protein 0.022 0.0546 0.4943
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.022 0.0546 0.0546
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0104 0.0247 0.0247
Echinococcus granulosus ecdysone induced protein 78C 0.022 0.0546 0.0546
Schistosoma mansoni ap endonuclease 0.0018 0.0025 0.0246
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0116 0.0279 0.2504
Echinococcus multilocularis FTZ F1 alpha 0.022 0.0546 0.0546
Onchocerca volvulus 0.022 0.0546 0.4837
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0056 0.0555
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0025 0.0025
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0056 0.0056
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0028 0.0215
Schistosoma mansoni mixed-lineage leukemia protein mll 0.006 0.0134 0.1342
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0116 0.0279 0.0279
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0028 0.0003
Brugia malayi Zinc finger, C2H2 type family protein 0.0063 0.0141 0.125
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Loa Loa (eye worm) hypothetical protein 0.003 0.0056 0.0467
Echinococcus multilocularis Polycystic kidney disease protein 0.0018 0.0027 0.0027
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0104 0.0247 0.2462
Mycobacterium ulcerans deoxycytidine triphosphate deaminase 0.0043 0.009 0.0065
Schistosoma mansoni cpg binding protein 0.0029 0.0055 0.0552
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0028 0.0021
Brugia malayi Pre-SET motif family protein 0.003 0.0056 0.047
Schistosoma mansoni nuclear receptor nhr-48 0.0104 0.0247 0.2462
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0028 0.0003
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Toxoplasma gondii dihydroorotate dehydrogenase reveal, putative 0.0161 0.0394 1
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Trypanosoma brucei dihydroorotate dehydrogenase (fumarate) 0.0161 0.0394 0.2618
Mycobacterium tuberculosis Probable anthranilate phosphoribosyltransferase TrpD 0.1097 0.2808 0.279
Plasmodium vivax kinesin-5 0.0029 0.0055 0.0834
Schistosoma mansoni thyroid hormone receptor 0.022 0.0546 0.545
Mycobacterium ulcerans thymidine phosphorylase 0.3886 1 1
Giardia lamblia Thymidine kinase 0.0577 0.1468 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0042 0.0088 0.0764
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0028 0.0021
Loa Loa (eye worm) kinesin-like protein KLP2 0.0029 0.0055 0.0465
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0104 0.0247 0.0247
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.022 0.0546 0.4943
Entamoeba histolytica thymidine kinase, putative 0.0577 0.1468 1
Echinococcus multilocularis lipoxygenase domain containing protein 0.0018 0.0027 0.0027
Entamoeba histolytica hypothetical protein 0.0043 0.009 0.0452
Schistosoma mansoni lipoxygenase 0.0051 0.0112 0.1119
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0138 0.0336 0.0907
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0028 0.0103
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Brugia malayi Nuclear hormone receptor-like 1 0.0116 0.0279 0.2506
Brugia malayi Phospholipase A2 family protein 0.0435 0.1101 1
Onchocerca volvulus Protein ultraspiracle homolog 0.022 0.0546 0.4837
Mycobacterium leprae Probable anthranilate phosphoribosyltransferase TrpD 0.1097 0.2808 1
Loa Loa (eye worm) hypothetical protein 0.022 0.0546 0.4943
Trichomonas vaginalis set domain proteins, putative 0.023 0.0573 0.3801
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0063 0.0141 0.0807
Echinococcus multilocularis RUN 0.0018 0.0027 0.0027
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0116 0.0279 0.2782
Schistosoma mansoni loxhd1 0.0018 0.0027 0.0267
Loa Loa (eye worm) hypothetical protein 0.022 0.0546 0.4943
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Echinococcus multilocularis thymidine phosphorylase 0.3886 1 1
Entamoeba histolytica hypothetical protein 0.0081 0.0187 0.1126
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.0028 0.0021
Brugia malayi nuclear hormone receptor 0.0104 0.0247 0.2213
Giardia lamblia Fructose-bisphosphate aldolase 0.0283 0.071 0.4749
Brugia malayi tailless protein 0.0104 0.0247 0.2213
Brugia malayi hypothetical protein 0.0018 0.0027 0.0207
Brugia malayi nuclear hormone receptor 0.022 0.0546 0.4944
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Entamoeba histolytica deoxycytidine triphosphate deaminase, putative 0.0043 0.009 0.0452
Schistosoma mansoni cpg binding protein 0.0028 0.0051 0.0511
Loa Loa (eye worm) hypothetical protein 0.022 0.0546 0.4943
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0056 0.0555
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Mycobacterium ulcerans anthranilate phosphoribosyltransferase 0.1097 0.2808 0.279
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0063 0.0141 0.0807
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0028 0.0003
Echinococcus granulosus dna polymerase kappa 0.0019 0.0028 0.0028
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein 0.0123 0.0298 0.1891
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0051 0.0112 0.0112
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0161 0.0394 0.2557
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.022 0.0546 0.0546
Schistosoma mansoni Tr4/Tr2 (homologue) 0.022 0.0546 0.545
Echinococcus granulosus retinoic acid receptor rxr beta a 0.022 0.0546 0.0546
Schistosoma mansoni nuclear hormone receptor 0.022 0.0546 0.545
Schistosoma mansoni hypothetical protein 0.0397 0.1002 1
Schistosoma mansoni nuclear receptor 0.0104 0.0247 0.2462
Schistosoma mansoni deoxyuridine 5'-triphosphate nucleotidohydrolase 0.0123 0.0298 0.297
Plasmodium falciparum kinesin-5 0.0029 0.0055 0.0834
Brugia malayi Nuclear hormone receptor family member nhr-1 0.022 0.0546 0.4944
Onchocerca volvulus 0.0104 0.0247 0.2049
Schistosoma mansoni coup transcription factor 0.022 0.0546 0.545
Loa Loa (eye worm) CXXC zinc finger family protein 0.0028 0.0051 0.0427
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase, mitochondrial precursor, putative 0.0123 0.0298 0.1891
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.022 0.0546 0.4943
Loa Loa (eye worm) hypothetical protein 0.0397 0.1003 0.9107
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0104 0.0247 0.2211
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.022 0.0546 0.0546
Leishmania major DNA polymerase eta, putative 0.0019 0.0028 0.0021
Echinococcus granulosus kinesin family 1 0.0227 0.0564 0.0564
Brugia malayi nuclear receptor RXR 0.0104 0.0247 0.2213
Schistosoma mansoni retinoic acid receptor RXR 0.022 0.0546 0.545
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein 0.0123 0.0298 0.1891
Loa Loa (eye worm) hypothetical protein 0.0018 0.0027 0.0205
Brugia malayi Nuclear hormone receptor-like 1 0.0116 0.0279 0.2506
Schistosoma mansoni cpg binding protein 0.0029 0.0055 0.0552
Echinococcus granulosus lipoxygenase domain containing protein 0.0018 0.0027 0.0027
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.022 0.0546 0.4943
Loa Loa (eye worm) hypothetical protein 0.022 0.0546 0.4943
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0063 0.0141 0.0807
Echinococcus multilocularis dUTP pyrophosphatase 0.0123 0.0298 0.0298
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0025 0.0082
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Loa Loa (eye worm) hypothetical protein 0.022 0.0546 0.4943
Brugia malayi nuclear hormone receptor family member odr-7 0.0104 0.0247 0.2213
Toxoplasma gondii deoxyuridine 5'-triphosphate nucleotidohydrolase, putative 0.0123 0.0298 0.7397
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0104 0.0247 0.0247
Brugia malayi steroid hormone receptor 0.022 0.0546 0.4944
Schistosoma mansoni nuclear receptor 0.0104 0.0247 0.2462
Echinococcus granulosus FTZ F1 alpha 0.022 0.0546 0.0546
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.022 0.0546 0.0546
Schistosoma mansoni rab6-interacting 0.0018 0.0027 0.0267
Wolbachia endosymbiont of Brugia malayi deoxycytidine triphosphate deaminase 0.0043 0.009 0.1769
Loa Loa (eye worm) nuclear hormone receptor 0.0104 0.0247 0.2211
Brugia malayi Nuclear hormone receptor-like 1 0.022 0.0546 0.4944
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0202 0.0501 0.4534
Brugia malayi ecdysone receptor 0.0104 0.0247 0.2213
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0028 0.0028
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0104 0.0247 0.0247
Brugia malayi Nuclear hormone receptor family member nhr-31 0.022 0.0546 0.4944
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0028 0.0021
Echinococcus granulosus dna polymerase eta 0.0019 0.0028 0.0028
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Echinococcus multilocularis cpg binding protein 0.0029 0.0055 0.0055
Brugia malayi hypothetical protein 0.0116 0.0279 0.2506
Chlamydia trachomatis deoxyuridine 5'-triphosphate nucleotidohydrolase 0.0123 0.0298 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.022 0.0546 0.4943
Brugia malayi ecdysteroid receptor 0.022 0.0546 0.4944
Mycobacterium ulcerans deoxyuridine 5'-triphosphate nucleotidohydrolase 0.0043 0.009 0.0065
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0104 0.0247 0.0247
Echinococcus granulosus nuclear receptor nhr 48 0.0104 0.0247 0.0247
Brugia malayi nuclear receptor NHR-88 0.022 0.0546 0.4944
Loa Loa (eye worm) doublecortin family protein 0.0018 0.0027 0.0205
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Mycobacterium tuberculosis Probable deoxycytidine triphosphate deaminase Dcd (dCTP deaminase) 0.0043 0.009 0.0065
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Echinococcus granulosus nuclear receptor 2DBD gamma 0.022 0.0546 0.0546
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Echinococcus multilocularis nuclear receptor nhr 48 0.0104 0.0247 0.0247
Loa Loa (eye worm) nuclear receptor NHR-67 0.0104 0.0247 0.2211
Brugia malayi follicle stimulating hormone receptor 0.0216 0.0536 0.4851
Treponema pallidum fructose-bisphosphate aldolase 0.0283 0.071 1
Entamoeba histolytica deoxycytidyl transferase, putative 0.0019 0.0028 0.0021
Brugia malayi photoreceptor-specific nuclear receptor 0.022 0.0546 0.4944
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Brugia malayi Nuclear hormone receptor family member nhr-14 0.022 0.0546 0.4944
Trypanosoma cruzi thymidine kinase, putative 0.0577 0.1468 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Trypanosoma cruzi thymidine kinase, putative 0.0577 0.1468 1
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0104 0.0247 0.2462
Schistosoma mansoni nuclear hormone receptor 0.0104 0.0247 0.2462
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0056 0.0555
Loa Loa (eye worm) hypothetical protein 0.0019 0.0028 0.0212
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0028 0.0003
Schistosoma mansoni thyroid hormone receptor 0.022 0.0546 0.545
Toxoplasma gondii kinesin motor domain-containing protein 0.0029 0.0055 0.0834
Schistosoma mansoni ap endonuclease 0.0018 0.0025 0.0246
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0216 0.0536 0.485
Loa Loa (eye worm) hypothetical protein 0.0018 0.0027 0.0205
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0028 0.0276
Trichomonas vaginalis thymidine kinase, putative 0.0577 0.1468 1
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0161 0.0394 0.3553
Brugia malayi hypothetical protein 0.0104 0.0247 0.2213
Loa Loa (eye worm) hypothetical protein 0.022 0.0546 0.4943
Brugia malayi nuclear receptor RXR 0.0116 0.0279 0.2506
Brugia malayi hypothetical protein 0.0104 0.0247 0.2213
Brugia malayi Pre-SET motif family protein 0.0202 0.0501 0.4535
Brugia malayi hypothetical protein 0.0116 0.0279 0.2506
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0051 0.0112 0.0112
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0056 0.0056
Trichomonas vaginalis thymidine kinase, putative 0.0577 0.1468 1
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0138 0.0336 0.0313
Echinococcus multilocularis kinesin family 1 0.0227 0.0564 0.0564
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.022 0.0546 0.4943
Mycobacterium leprae Probable dihydroorotate dehydrogenase PyrD 0.0161 0.0394 0.1118
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Plasmodium falciparum deoxyuridine 5'-triphosphate nucleotidohydrolase 0.0123 0.0298 0.7397
Loa Loa (eye worm) hypothetical protein 0.0116 0.0279 0.2504
Schistosoma mansoni lipoxygenase 0.0018 0.0027 0.0267
Echinococcus multilocularis dnaJ subfamily B 0.0397 0.1002 0.1002
Echinococcus granulosus cpg binding protein 0.0029 0.0055 0.0055
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0138 0.0336 0.0313
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0028 0.0103
Brugia malayi Nuclear hormone receptor family member nhr-40 0.022 0.0546 0.4944
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0063 0.0141 0.0141
Leishmania major thymidine kinase, putative 0.0577 0.1468 1
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0104 0.0247 0.0247
Entamoeba histolytica deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein 0.0123 0.0298 0.1891
Loa Loa (eye worm) hypothetical protein 0.0435 0.1101 1
Schistosoma mansoni polycystin 1-related 0.0018 0.0027 0.0267
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0283 0.071 0.4749
Brugia malayi nuclear hormone receptor family member nhr-6 0.0104 0.0247 0.2213
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0116 0.0279 0.0279
Loa Loa (eye worm) hypothetical protein 0.0116 0.0279 0.2504
Brugia malayi Nuclear hormone receptor family member nhr-49 0.022 0.0546 0.4944
Brugia malayi nuclear receptor NHR-88 0.0104 0.0247 0.2213
Echinococcus granulosus RUN 0.0018 0.0027 0.0027
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.022 0.0546 0.4943
Schistosoma mansoni kinesin eg-5 0.0029 0.0055 0.0553
Loa Loa (eye worm) DR-78 0.0104 0.0247 0.2211
Echinococcus granulosus Nuclear hormone receptor HR96 0.0104 0.0247 0.0247
Brugia malayi orphan nuclear receptor NR2E1 0.0104 0.0247 0.2213
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0104 0.0247 0.2049
Trypanosoma brucei unspecified product 0.0019 0.0028 0.0103
Loa Loa (eye worm) hypothetical protein 0.0116 0.0279 0.2504
Echinococcus multilocularis dna polymerase eta 0.0019 0.0028 0.0028
Schistosoma mansoni dihydroorotate dehydrogenase 0.0161 0.0394 0.3928
Plasmodium vivax deoxyuridine 5'-triphosphate nucleotidohydrolase, putative 0.0123 0.0298 0.7397
Mycobacterium tuberculosis Probable dihydroorotate dehydrogenase PyrD 0.0161 0.0394 0.037
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0028 0.0021
Entamoeba histolytica kinesin, putative 0.0029 0.0055 0.0213
Echinococcus granulosus Polycystic kidney disease protein 0.0018 0.0027 0.0027
Echinococcus granulosus thyroid hormone receptor alpha 0.0104 0.0247 0.0247
Giardia lamblia Kinesin-5 0.0029 0.0055 0.0213
Schistosoma mansoni hypothetical protein 0.0018 0.0027 0.0267
Schistosoma mansoni RAR-like nuclear receptor 0.022 0.0546 0.545
Brugia malayi Nuclear hormone receptor family member nhr-25 0.022 0.0546 0.4944
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Onchocerca volvulus Bile acid receptor homolog 0.022 0.0546 0.4837
Brugia malayi nuclear receptor NHR-67 0.0104 0.0247 0.2213
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.022 0.0546 0.545
Plasmodium vivax SET domain protein, putative 0.003 0.0056 0.084
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0025 0.0025
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.022 0.0546 0.0546
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0063 0.0141 0.0141
Leishmania major dihydroorotate dehydrogenase 0.0161 0.0394 0.2557
Echinococcus multilocularis ecdysone induced protein 78C 0.022 0.0546 0.0546
Schistosoma mansoni hypothetical protein 0.0197 0.0488 0.4873
Loa Loa (eye worm) steroid hormone receptor 0.022 0.0546 0.4943
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0028 0.0215
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0028 0.0103
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.022 0.0546 0.0546
Loa Loa (eye worm) hypothetical protein 0.0116 0.0279 0.2504
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0161 0.0394 0.2557
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0063 0.0141 0.0807
Schistosoma mansoni retinoid-x-receptor (RXR) 0.022 0.0546 0.545
Brugia malayi Nuclear hormone receptor family member nhr-41 0.022 0.0546 0.4944
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0063 0.0141 0.0807
Mycobacterium ulcerans dihydroorotate dehydrogenase 2 0.0161 0.0394 0.037
Schistosoma mansoni nuclear hormone receptor 0.0104 0.0247 0.2462
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.0063 0.0141 0.0807
Trypanosoma cruzi dihydroorotate dehydrogenase (fumarate), putative 0.0161 0.0394 0.2557
Onchocerca volvulus 0.0028 0.0051 0.0227
Plasmodium vivax dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0161 0.0394 1
Echinococcus granulosus dUTP pyrophosphatase 0.0123 0.0298 0.0298
Trypanosoma cruzi DNA polymerase eta, putative 0.0019 0.0028 0.0021
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0028 0.0103
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0104 0.0247 0.2213
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0116 0.0279 0.2782
Schistosoma mansoni steroid hormone receptor ad4bp 0.022 0.0546 0.545
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0028 0.0276
Loa Loa (eye worm) hypothetical protein 0.0104 0.0247 0.2211
Brugia malayi CXXC zinc finger family protein 0.0028 0.0051 0.043
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0063 0.0141 0.0807
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.022 0.0546 0.4943
Plasmodium vivax multidomain scavenger receptor, putative 0.0018 0.0027 0.0059
Echinococcus granulosus nuclear receptor 2DBD gamma 0.022 0.0546 0.0546
Onchocerca volvulus Phospholipase A2 homolog 0.0397 0.1003 0.9088
Mycobacterium tuberculosis Probable thymidine phosphorylase DeoA (tdrpase) (pyrimidine phosphorylase) 0.3886 1 1
Loa Loa (eye worm) hypothetical protein 0.0116 0.0279 0.2504
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0056 0.0555
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0028 0.0212
Echinococcus granulosus dnaJ subfamily B 0.0397 0.1002 0.1002
Brugia malayi Kinesin motor domain containing protein 0.0029 0.0055 0.0468
Echinococcus granulosus Nuclear hormone receptor HR96 0.0104 0.0247 0.0247

Activities

Activity type Activity value Assay description Source Reference
Inhibition (binding) NC 0 Ability to inhibit Catechol O-methyltransferase from rat liver at a concentration of 1 mM. Inhibition pattern was reported; Noncompetitive kinetics ChEMBL. 7069704
Kii (binding) = 16.5 uM Ability to inhibit Catechol O-methyltransferase kinetic inhibition Kii constant was reported. ChEMBL. 7069704
Kii (binding) = 16.5 uM Ability to inhibit Catechol O-methyltransferase kinetic inhibition Kii constant was reported. ChEMBL. 7069704
Kis (binding) = 31.8 uM Ability to inhibit Catechol O-methyltransferase kinetic inhibition Kis constant was reported. ChEMBL. 7069704
Kis (binding) = 31.8 uM Ability to inhibit Catechol O-methyltransferase kinetic inhibition Kis constant was reported. ChEMBL. 7069704

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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