Detailed information for compound 340962

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 313.301 | Formula: C17H13F2N3O
  • H donors: 0 H acceptors: 2 LogP: 3.08 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1cccc(c1COc1ccc2c(c1)CCc1n2cnn1)F
  • InChi: 1S/C17H13F2N3O/c18-14-2-1-3-15(19)13(14)9-23-12-5-6-16-11(8-12)4-7-17-21-20-10-22(16)17/h1-3,5-6,8,10H,4,7,9H2
  • InChiKey: VXNNDPYEHYYEHN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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 hypothetical protein 0.0015 0.0012 0.0193
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0007 0.0115
Brugia malayi polk-prov protein 0.0007 0.0001 0.0001
Echinococcus multilocularis dna polymerase eta 0.0022 0.0021 0.0343
Giardia lamblia DINP protein human, muc B family 0.0022 0.0021 0.0073
Echinococcus granulosus disco interacting protein 2 0.0043 0.0049 0.0819
Echinococcus granulosus BRK domain containing protein 0.0013 0.0009 0.0153
Schistosoma mansoni hypothetical protein 0.0007 0.0001 0.001
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0029 0.0031 0.0112
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0007 0.0115
Loa Loa (eye worm) BRM protein 0.0048 0.0056 0.1238
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0007 0.0154
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0007 0.0115
Schistosoma mansoni DNA polymerase IV / kappa 0.0007 0.0001 0.0013
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0007 0.0115
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0007 0.001
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0021 0.002 0.0073
Schistosoma mansoni hypothetical protein 0.0189 0.0244 0.4064
Trypanosoma brucei unspecified product 0.0015 0.0012 0.0043
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0007 0.0115
Schistosoma mansoni polybromo-1 0.0007 0.0001 0.0019
Toxoplasma gondii HEAT repeat-containing protein 0.0032 0.0035 0.0128
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0015 0.0256
Brugia malayi BRM protein 0.0075 0.0092 0.0126
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.002 0.0073
Echinococcus multilocularis muscleblind protein 1 0.0167 0.0214 0.3566
Loa Loa (eye worm) hypothetical protein 0.0011 0.0007 0.0154
Loa Loa (eye worm) hypothetical protein 0.0167 0.0214 0.476
Plasmodium falciparum importin beta, putative 0.0032 0.0035 0.0128
Brugia malayi MH2 domain containing protein 0.0133 0.017 0.0233
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0047 0.0055 0.0199
Plasmodium vivax flap endonuclease 1, putative 0.0029 0.0031 0.0112
Brugia malayi Disco-interacting protein 2 homolog 0.0043 0.0049 0.0068
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0068 0.0083 0.1374
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0007 0.001
Toxoplasma gondii isocitrate dehydrogenase 0.0018 0.0015 0.0057
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Plasmodium vivax DNA (cytosine-5)-methyltransferase, putative 0.0022 0.0021 0.0078
Trypanosoma brucei importin beta-1 subunit, putative 0.0032 0.0035 0.0128
Echinococcus multilocularis smad 0.0009 0.0004 0.0066
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0007 0.0001 0.0003
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0007 0.0115
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0009 0.0153
Echinococcus granulosus Chromo domain 0.0013 0.0009 0.0153
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0007 0.0115
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0022 0.0021 0.0517
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.002 0.0498
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0012 0.0043
Trypanosoma cruzi importin beta-1 subunit, putative 0.0026 0.0027 0.0095
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.016 0.0205 0.0748
Echinococcus granulosus helicase 0.0007 0.0001 0.001
Plasmodium vivax DNA repair protein REV1, putative 0.0007 0.0001 0.0003
Loa Loa (eye worm) hypothetical protein 0.0011 0.0007 0.0154
Brugia malayi isocitrate dehydrogenase 0.0018 0.0015 0.0021
Toxoplasma gondii hypothetical protein 0.0054 0.0064 0.0236
Plasmodium falciparum flap endonuclease 1 0.0029 0.0031 0.0112
Mycobacterium ulcerans hypothetical protein 0.0178 0.0229 0.5726
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.0388 0.0509 1
Schistosoma mansoni helicase 0.0075 0.0092 0.1529
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0007 0.0115
Schistosoma mansoni helicase 0.0007 0.0001 0.001
Echinococcus granulosus Smad4 0.0009 0.0004 0.0066
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.205 0.2725 1
Schistosoma mansoni disco-interacting protein 2 (dip2) 0.0043 0.0049 0.0819
Brugia malayi Telomerase reverse transcriptase 0.5456 0.7266 1
Entamoeba histolytica hypothetical protein 0.004 0.0045 0.0892
Toxoplasma gondii SWI2/SNF2 Brahma-like putative 0.0014 0.001 0.0037
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.002 0.0442
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0021 0.0073
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0007 0.0115
Trypanosoma brucei cytosine-specific DNA methylase, putative 0.0022 0.0021 0.0078
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0021 0.0076
Trypanosoma brucei hypothetical protein, conserved 0.0007 0.0001 0.0003
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0007 0.001
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0007 0.0006
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0007 0.0115
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0022 0.0021 0.0343
Loa Loa (eye worm) hypothetical protein 0.0011 0.0007 0.0154
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0021 0.0498
Echinococcus granulosus mixed lineage leukemia protein mll 0.0008 0.0003 0.0042
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0337 0.0441 0.1617
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.002 0.0073
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0022 0.0021 0.0076
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0021 0.0073
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0021 0.0076
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0008 0.0003 0.0042
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0018 0.0015 0.0256
Brugia malayi F/Y-rich N-terminus family protein 0.001 0.0005 0.0007
Loa Loa (eye worm) glutaminase 2 0.0305 0.0399 0.886
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0009 0.0153
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Schistosoma mansoni cpg binding protein 0.0071 0.0087 0.1447
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.004 0.0045 0.0756
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0007 0.0115
Schistosoma mansoni hypothetical protein 0.004 0.0045 0.0756
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0018 0.0015 0.0256
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0337 0.0441 0.162
Loa Loa (eye worm) hypothetical protein 0.0032 0.0035 0.0773
Echinococcus granulosus dnaJ subfamily B 0.0457 0.0601 1
Leishmania major modification methylase-like protein 0.0022 0.0021 0.0078
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0094 0.0118 0.0432
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0007 0.0154
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0021 0.002 0.0479
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0007 0.001
Loa Loa (eye worm) hypothetical protein 0.0043 0.0049 0.1094
Loa Loa (eye worm) isocitrate dehydrogenase 0.0018 0.0015 0.0342
Leishmania major DNA polymerase kappa, putative 0.0007 0.0001 0.0003
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0022 0.0021 0.0343
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0007 0.001
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Entamoeba histolytica Flap nuclease, putative 0.0029 0.0031 0.0602
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0007 0.0115
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0007 0.001
Giardia lamblia Flap structure-specific endonuclease 0.0029 0.0031 0.011
Brugia malayi MH2 domain containing protein 0.0009 0.0004 0.0005
Loa Loa (eye worm) SNF2 family domain-containing protein 0.0007 0.0001 0.0013
Treponema pallidum exodeoxyribonuclease (exoA) 0.0021 0.002 0.5
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0009 0.0153
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0047 0.0055 0.0199
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0009 0.0153
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0015 0.0256
Mycobacterium tuberculosis Conserved hypothetical protein 0.0022 0.0021 0.0244
Onchocerca volvulus 0.0069 0.0085 0.0084
Brugia malayi polybromodomain protein 0.0007 0.0001 0.0002
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0021 0.0073
Echinococcus granulosus snurportin 1 0.0344 0.045 0.7492
Leishmania major DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Loa Loa (eye worm) hypothetical protein 0.0011 0.0007 0.0154
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0007 0.0115
Entamoeba histolytica hypothetical protein 0.0026 0.0027 0.0524
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0029 0.0031 0.0112
Echinococcus multilocularis isocitrate dehydrogenase 0.0018 0.0015 0.0256
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.011 0.0139 0.2731
Trypanosoma cruzi DNA polymerase kappa, putative 0.0022 0.0021 0.0073
Brugia malayi CXXC zinc finger family protein 0.0069 0.0085 0.0116
Brugia malayi Associated with TFs and helicases family protein 0.0013 0.0009 0.0013
Loa Loa (eye worm) hypothetical protein 0.0011 0.0007 0.0154
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Schistosoma mansoni importin beta-1 0.0032 0.0035 0.0579
Entamoeba histolytica hypothetical protein 0.004 0.0045 0.0892
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0007 0.0115
Plasmodium vivax telomerase reverse transcriptase, putative 0.205 0.2725 1
Brugia malayi Muscleblind-like protein 0.0167 0.0214 0.0295
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0007 0.0115
Echinococcus granulosus muscleblind protein 0.0167 0.0214 0.3566
Loa Loa (eye worm) helicase DNA-binding protein 0.0013 0.0009 0.0204
Toxoplasma gondii RNA-directed DNA polymerase 0.205 0.2725 1
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0021 0.002 0.039
Trypanosoma brucei DNA polymerase IV, putative 0.0022 0.0021 0.0076
Schistosoma mansoni DNA (cytosine-5)-methyltransferase 0.0022 0.0021 0.0354
Echinococcus multilocularis cpg binding protein 0.0071 0.0087 0.1447
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0337 0.0441 0.1617
Trypanosoma brucei DNA polymerase kappa, putative 0.0007 0.0001 0.0003
Loa Loa (eye worm) CXXC zinc finger family protein 0.0069 0.0085 0.1878
Brugia malayi nuclear receptor NHR-88 0.0011 0.0007 0.001
Echinococcus granulosus dna polymerase eta 0.0022 0.0021 0.0343
Loa Loa (eye worm) Smad1 0.0009 0.0004 0.0089
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0026 0.0027 0.0669
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0007 0.0115
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0009 0.0153
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0007 0.0115
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0021 0.002 0.007
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Brugia malayi MH1 domain containing protein 0.0009 0.0004 0.0005
Loa Loa (eye worm) hypothetical protein 0.0007 0.0001 0.0018
Echinococcus multilocularis Chromo domain 0.0013 0.0009 0.0153
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0021 0.002 0.0073
Schistosoma mansoni hypothetical protein 0.0457 0.0601 1
Echinococcus granulosus cpg binding protein 0.0071 0.0087 0.1447
Plasmodium falciparum DEAD/DEAH box helicase, putative 0.0012 0.0007 0.0027
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0008 0.0003 0.0042
Schistosoma mansoni Smad4 0.0009 0.0004 0.0066
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0007 0.001
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0007 0.0115
Brugia malayi Flap endonuclease-1 0.0029 0.0031 0.0042
Plasmodium falciparum telomerase reverse transcriptase 0.205 0.2725 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0021 0.0458
Brugia malayi ecdysteroid receptor 0.0011 0.0007 0.001
Toxoplasma gondii hypothetical protein 0.0094 0.0118 0.0432
Trypanosoma brucei DNA polymerase eta, putative 0.0022 0.0021 0.0076
Leishmania major DNA polymerase eta, putative 0.0007 0.0001 0.0003
Onchocerca volvulus 0.0043 0.0049 0.0049
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0007 0.0006
Entamoeba histolytica hypothetical protein 0.004 0.0045 0.0892
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0002 0.0039
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0021 0.002 0.007
Echinococcus multilocularis chromodomain helicase DNA binding protein 7 0.0013 0.0009 0.0153
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0015 0.0256
Echinococcus multilocularis snurportin 1 0.0344 0.045 0.7492
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0007 0.0115
Toxoplasma gondii histone lysine methyltransferase SET1 0.0063 0.0076 0.0277
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0007 0.0154
Loa Loa (eye worm) hypothetical protein 0.0007 0.0001 0.0025
Plasmodium vivax DEAD/DEAH helicase, putative 0.0012 0.0007 0.0027
Entamoeba histolytica deoxycytidyl transferase, putative 0.0022 0.0021 0.0405
Echinococcus multilocularis Smad4 0.0009 0.0004 0.0066
Echinococcus multilocularis flap endonuclease 1 0.0029 0.0031 0.051
Echinococcus multilocularis disco interacting protein 2 0.0043 0.0049 0.0819
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0007 0.0115
Giardia lamblia Telomerase catalytic subunit 0.205 0.2725 1
Trichomonas vaginalis helicase, putative 0.0007 0.0002 0.0039
Echinococcus granulosus global transcription activator snf2l2 0.0075 0.0092 0.1529
Schistosoma mansoni smad1 5 8 and 0.0009 0.0004 0.0066
Plasmodium falciparum DNA repair protein REV1, putative 0.0007 0.0001 0.0003
Echinococcus granulosus TGF beta signal transducer SmadC 0.0009 0.0004 0.0066
Echinococcus multilocularis importin subunit beta 1 0.0032 0.0035 0.0579
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0012 0.0043
Echinococcus granulosus geminin 0.0189 0.0244 0.4064
Leishmania major DNA polymerase eta, putative 0.0022 0.0021 0.0076
Toxoplasma gondii SWI2/SNF2 Brahma-like putative 0.0012 0.0007 0.0027
Schistosoma mansoni coup transcription factor 0.0011 0.0007 0.0115
Plasmodium vivax helicase, putative 0.0007 0.0001 0.0002
Onchocerca volvulus 0.0011 0.0007 0.0006
Echinococcus multilocularis polybromo 1 0.0007 0.0001 0.0019
Echinococcus multilocularis geminin 0.0189 0.0244 0.4064
Loa Loa (eye worm) MH2 domain-containing protein 0.0009 0.0004 0.0089
Schistosoma mansoni DNA polymerase eta 0.0022 0.0021 0.0343
Schistosoma mansoni glutaminase 0.0305 0.0399 0.6638
Brugia malayi nuclear hormone receptor 0.0011 0.0007 0.001
Toxoplasma gondii isocitrate dehydrogenase 0.0018 0.0015 0.0057
Trypanosoma brucei hypothetical protein, conserved 0.0007 0.0001 0.0003
Schistosoma mansoni helicase 0.0007 0.0001 0.001
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0002 0.0039
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0007 0.001
Trypanosoma brucei DNA polymerase kappa, putative 0.0007 0.0001 0.0003
Brugia malayi Importin beta-1 subunit 0.0032 0.0035 0.0048
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Entamoeba histolytica DNA (cytosine-5)-methyltransferase, putative 0.0022 0.0021 0.0418
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0015 0.0057
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0015 0.0057
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.002 0.0331
Brugia malayi SNF2 family N-terminal domain containing protein 0.0007 0.0001 0.0001
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0021 0.0028
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0007 0.0001 0.0003
Leishmania major DNA damage repair protein, putative 0.0007 0.0001 0.0003
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0007 0.0154
Echinococcus multilocularis global transcription activator snf2l2 0.0075 0.0092 0.1529
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0021 0.002 0.007
Schistosoma mansoni hypothetical protein 0.0344 0.045 0.7492
Loa Loa (eye worm) histone methyltransferase 0.001 0.0005 0.0113
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0022 0.0021 0.0458
Trichomonas vaginalis lymphoid specific helicase, putative 0.0014 0.001 0.0253
Plasmodium falciparum Snf2-related CBP activator, putative 0.0007 0.0001 0.0002
Schistosoma mansoni cpg binding protein 0.0071 0.0087 0.1447
Echinococcus multilocularis BRK domain 0.0013 0.0009 0.0153
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0007 0.001
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0021 0.002 0.021
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0047 0.0055 0.0199
Schistosoma mansoni hypothetical protein 0.0189 0.0244 0.4064
Echinococcus granulosus importin subunit beta 1 0.0032 0.0035 0.0579
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0007 0.0115
Echinococcus granulosus smad 0.0009 0.0004 0.0066
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0018 0.0015 0.0256
Mycobacterium ulcerans glutaminase 0.0305 0.0399 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0007 0.001
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.002 0.0027
Schistosoma mansoni hypothetical protein 0.0013 0.0009 0.0153
Mycobacterium ulcerans DNA polymerase IV 0.0022 0.0021 0.0498
Plasmodium vivax hypothetical protein, conserved 0.0007 0.0001 0.0002
Trypanosoma brucei DNA polymerase kappa, putative 0.0015 0.0012 0.0043
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0344 0.045 1
Brugia malayi MH2 domain containing protein 0.0009 0.0004 0.0005
Leishmania major mitochondrial DNA polymerase beta 0.0337 0.0441 0.162
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0029 0.0031 0.0112
Echinococcus multilocularis Helicase SANT associated, DNA binding 0.0007 0.0001 0.001
Toxoplasma gondii exonuclease III APE 0.0021 0.002 0.0073
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0026 0.0027 0.0669
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0007 0.001
Loa Loa (eye worm) transcription factor SMAD2 0.0133 0.017 0.3768
Trichomonas vaginalis glutaminase, putative 0.0305 0.0399 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0032 0.0035 0.0128
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0007 0.0115
Loa Loa (eye worm) hypothetical protein 0.0167 0.0214 0.476
Trypanosoma brucei telomerase reverse transcriptase 0.205 0.2725 1
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0009 0.0004 0.0066
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0007 0.0154
Echinococcus granulosus DNA methyltransferase 2, putative 0.0022 0.0021 0.0354
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.205 0.2725 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.001 0.0005 0.0085
Echinococcus granulosus dna polymerase kappa 0.0022 0.0021 0.0343
Echinococcus multilocularis mothers against decapentaplegic 5 0.0009 0.0004 0.0066
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Entamoeba histolytica hypothetical protein 0.004 0.0045 0.0892
Schistosoma mansoni ap endonuclease 0.0021 0.002 0.0331
Schistosoma mansoni cpg binding protein 0.0069 0.0085 0.1407
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0021 0.002 0.5
Loa Loa (eye worm) MH2 domain-containing protein 0.0133 0.017 0.3768
Brugia malayi Smad1 0.0009 0.0004 0.0005
Brugia malayi steroid hormone receptor 0.0011 0.0007 0.001
Plasmodium vivax importin-beta 2, putative 0.0032 0.0035 0.0128
Brugia malayi ImpB/MucB/SamB family protein 0.0022 0.0021 0.0028
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.001 0.0005 0.0085
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Echinococcus multilocularis muscleblind protein 0.0167 0.0214 0.3566
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0007 0.001
Echinococcus multilocularis dna polymerase kappa 0.0022 0.0021 0.0343
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0022 0.0021 0.0244
Loa Loa (eye worm) hypothetical protein 0.0011 0.0007 0.0154
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.004 0.0045 0.0756
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0007 0.0115
Echinococcus granulosus flap endonuclease 1 0.0029 0.0031 0.051
Loa Loa (eye worm) hypothetical protein 0.0011 0.0007 0.0154
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0018 0.0015 0.0054
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.002 0.0498
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.002 0.0331
Brugia malayi SET domain containing protein 0.0007 0.0002 0.0003
Leishmania major importin beta-1 subunit, putative 0.0026 0.0027 0.0098
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0009 0.0004 0.0066
Trypanosoma cruzi DNA polymerase eta, putative 0.0022 0.0021 0.0073
Plasmodium falciparum DNA (cytosine-5)-methyltransferase 0.0022 0.0021 0.0078
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0007 0.001
Echinococcus multilocularis DNA methyltransferase 2, putative 0.0022 0.0021 0.0354
Echinococcus multilocularis BRK domain containing protein 0.0013 0.0009 0.0153
Schistosoma mansoni transcription factor LCR-F1 0.004 0.0045 0.0756
Trichomonas vaginalis importin beta-1, putative 0.0026 0.0027 0.0669
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Giardia lamblia DNA repair protein RAD52 0.0388 0.0509 0.1867
Schistosoma mansoni terminal deoxycytidyl transferase 0.0022 0.0021 0.0343
Schistosoma mansoni smad1 5 8 and 0.0009 0.0004 0.0066
Schistosoma mansoni ap endonuclease 0.0021 0.002 0.0331
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Trypanosoma brucei unspecified product 0.0015 0.0012 0.0043
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0007 0.0154
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Toxoplasma gondii DNA methyltransferase 2, putative 0.0022 0.0021 0.0078
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0007 0.0115
Trypanosoma brucei chrX additional, unordered contigs 0.0007 0.0001 0.0003
Schistosoma mansoni smad 0.0009 0.0004 0.0066
Loa Loa (eye worm) glutaminase 0.0305 0.0399 0.886
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0007 0.0001 0.0003
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Brugia malayi RNA, U transporter 1 0.0092 0.0114 0.0157
Schistosoma mansoni flap endonuclease-1 0.0026 0.0027 0.0448
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.016 0.0205 0.0751
Trypanosoma brucei unspecified product 0.0022 0.0021 0.0076
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0007 0.0115
Brugia malayi glutaminase DH11.1 0.0305 0.0399 0.0549
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0007 0.0006
Trypanosoma brucei DNA damage repair protein, putative 0.0007 0.0001 0.0003
Loa Loa (eye worm) BRM protein 0.0039 0.0044 0.0968
Echinococcus multilocularis dnaJ subfamily B 0.0457 0.0601 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0058 0.0069 0.025
Brugia malayi Isocitrate dehydrogenase 0.0018 0.0015 0.0021
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0008 0.0003 0.0042
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Brugia malayi hypothetical protein 0.004 0.0045 0.0063
Trypanosoma brucei DNA polymerase kappa, putative 0.0022 0.0021 0.0076
Loa Loa (eye worm) hypothetical protein 0.0007 0.0001 0.0021
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0022 0.0021 0.0343
Echinococcus granulosus polybromo 1 0.0007 0.0001 0.0019
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Echinococcus multilocularis helicase 0.0007 0.0001 0.001
Mycobacterium tuberculosis Conserved hypothetical protein 0.0178 0.0229 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0007 0.0154
Schistosoma mansoni smad1 5 8 and 0.0009 0.0004 0.0066
Loa Loa (eye worm) flap endonuclease-1 0.0029 0.0031 0.0681
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.0003 0.0042
Loa Loa (eye worm) MH1 domain-containing protein 0.0009 0.0004 0.0089
Toxoplasma gondii C-5 cytosine-specific DNA methylase superfamily protein 0.0022 0.0021 0.0078
Echinococcus granulosus mothers against decapentaplegic 5 0.0009 0.0004 0.0066
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0002 0.0039
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0002 0.0039
Leishmania major telomerase reverse transcriptase, putative 0.205 0.2725 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0015 0.0054
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0007 0.0115
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0007 0.0115
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0007 0.001
Entamoeba histolytica hypothetical protein 0.011 0.0139 0.2731
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0007 0.0115
Loa Loa (eye worm) hypothetical protein 0.0011 0.0007 0.0154
Trichomonas vaginalis DNA polymerase eta, putative 0.0022 0.0021 0.0517
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.016 0.0205 0.0751
Brugia malayi MH1 domain containing protein 0.0009 0.0004 0.0005
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0029 0.0031 0.011
Trypanosoma brucei DNA damage repair protein, putative 0.0007 0.0001 0.0003
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0007 0.001
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0018 0.0015 0.0057
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0047 0.0055 0.0202
Trichomonas vaginalis flap endonuclease-1, putative 0.0029 0.0031 0.0768
Echinococcus granulosus Helicase SANT associated DNA binding 0.0007 0.0001 0.001
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0007 0.0115
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0018 0.0015 0.0057
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0007 0.001
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0007 0.0154
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0018 0.0015 0.0057
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0007 0.0115

Activities

Activity type Activity value Assay description Source Reference
DOSE (functional) mg kg-1 Concentration of the compound producing seizure after 0.5 hrs tested by ScMet (Subcutaneous pentylenetetrazol test) done after 30 min of administration of 85 mg/kg pentylenetetrazol in mouse; na=no activity ChEMBL. 16139502
DOSE (functional) mg kg-1 Concentration producing seizure after 4 hrs tested by ScMet (Subcutaneous pentylenetetrazol test) done after 30 min of administration of 85 mg/kg pentylenetetrazol in mouse; na=no activity ChEMBL. 16139502
DOSE (functional) mg kg-1 Concentration producing anticonvulsant drug-induced neurologic deficit after 4 hrs done by rotorod ataxia test in mouse; na=no activity ChEMBL. 16139502
DOSE (functional) mg kg-1 Concentration producing seizure after 4 hrs tested by MES (Maximal ElectroShock test) done after 30 min of administration in mouse; na=no activity ChEMBL. 16139502
DOSE (functional) mg kg-1 Concentration of the compound producing seizure after 0.5 hrs tested by MES (Maximal ElectroShock test) done after 30 min of administration in mouse; na=no activity ChEMBL. 16139502
DOSE (functional) mg kg-1 Concentration of compound producing anticonvulsant drug-induced neurologic deficit after 0.5 hrs done by rotorod ataxia test in mouse; na=no activity ChEMBL. 16139502
Dose (functional) NA 0 mg kg-1 Concentration of the compound producing seizure after 0.5 hrs tested by MES (Maximal ElectroShock test) done after 30 min of administration in mouse; na=no activity ChEMBL. 16139502
Dose (functional) NA 0 mg kg-1 Concentration producing seizure after 4 hrs tested by MES (Maximal ElectroShock test) done after 30 min of administration in mouse; na=no activity ChEMBL. 16139502
Dose (functional) NA 0 mg kg-1 Concentration of the compound producing seizure after 0.5 hrs tested by ScMet (Subcutaneous pentylenetetrazol test) done after 30 min of administration of 85 mg/kg pentylenetetrazol in mouse; na=no activity ChEMBL. 16139502
Dose (functional) NA 0 mg kg-1 Concentration producing seizure after 4 hrs tested by ScMet (Subcutaneous pentylenetetrazol test) done after 30 min of administration of 85 mg/kg pentylenetetrazol in mouse; na=no activity ChEMBL. 16139502
Dose (functional) NA 0 mg kg-1 Concentration of compound producing anticonvulsant drug-induced neurologic deficit after 0.5 hrs done by rotorod ataxia test in mouse; na=no activity ChEMBL. 16139502
Dose (functional) NA 0 mg kg-1 Concentration producing anticonvulsant drug-induced neurologic deficit after 4 hrs done by rotorod ataxia test in mouse; na=no activity ChEMBL. 16139502

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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