Detailed information for compound 1271247

Basic information

Technical information
  • TDR Targets ID: 1271247
  • Name: N-(2-methoxyphenyl)-2-[(3-methyl-4-oxo-[1]ben zoxolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamid e
  • MW: 395.432 | Formula: C20H17N3O4S
  • H donors: 1 H acceptors: 2 LogP: 3.43 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1NC(=O)CSc1nc2c(c(=O)n1C)oc1c2cccc1
  • InChi: 1S/C20H17N3O4S/c1-23-19(25)18-17(12-7-3-5-9-14(12)27-18)22-20(23)28-11-16(24)21-13-8-4-6-10-15(13)26-2/h3-10H,11H2,1-2H3,(H,21,24)
  • InChiKey: RRPANSVDTDVVGV-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(2-methoxyphenyl)-2-(3-methyl-4-oxo-benzofurano[3,2-d]pyrimidin-2-yl)sulfanyl-acetamide
  • N-(2-methoxyphenyl)-2-[(3-methyl-4-oxo-2-benzofurano[3,2-d]pyrimidinyl)thio]acetamide
  • 2-[(4-keto-3-methyl-benzofurano[3,2-d]pyrimidin-2-yl)thio]-N-(2-methoxyphenyl)acetamide
  • N-(2-methoxyphenyl)-2-[(3-methyl-4-oxo-[1]benzoxolo[3,2-d]pyrimidin-2-yl)sulfanyl]ethanamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0016 0.0022
Toxoplasma gondii flap structure-specific endonuclease 1, putative 0.0027 0.0069 0.0252
Schistosoma mansoni smad1 5 8 and 0.0008 0.0009 0.0069
Schistosoma mansoni hypothetical protein 0.0012 0.0021 0.0156
Leishmania major mitochondrial DNA polymerase beta 0.0311 0.0987 0.3629
Loa Loa (eye worm) hypothetical protein 0.002 0.0046 0.0461
Plasmodium vivax DEAD/DEAH helicase, putative 0.0011 0.0017 0.0061
Onchocerca volvulus 0.0064 0.0189 0.0188
Schistosoma mansoni polybromo-1 0.0006 0.0003 0.0022
Entamoeba histolytica deoxycytidyl transferase, putative 0.002 0.0046 0.0405
Echinococcus granulosus cpg binding protein 0.0066 0.0195 0.145
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Toxoplasma gondii SWI2/SNF2 Brahma-like putative 0.0013 0.0023 0.0083
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0046 0.0163
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0848 0.2718 1
Trichomonas vaginalis DNA polymerase eta, putative 0.002 0.0046 0.0517
Plasmodium falciparum telomerase reverse transcriptase 0.0848 0.2718 1
Trypanosoma brucei hypothetical protein, conserved 0.0006 0.0002 0.0007
Loa Loa (eye worm) hypothetical protein 0.003 0.0078 0.0777
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0016 0.0118
Brugia malayi MH1 domain containing protein 0.0008 0.0009 0.0013
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0016 0.0022
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0016 0.0118
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0046 0.0064
Echinococcus multilocularis cpg binding protein 0.0066 0.0195 0.145
Echinococcus multilocularis BRK domain containing protein 0.0012 0.0021 0.0156
Echinococcus multilocularis Smad4 0.0008 0.0009 0.0069
Plasmodium falciparum DNA repair protein REV1, putative 0.0006 0.0002 0.0007
Echinococcus multilocularis BRK domain containing protein 0.0012 0.0021 0.0156
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0045 0.0498
Trypanosoma cruzi DNA polymerase eta, putative 0.002 0.0046 0.0163
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0009 0.0069
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Echinococcus multilocularis dnaJ subfamily B 0.0422 0.1343 1
Trypanosoma brucei unspecified product 0.0014 0.0027 0.0096
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0016 0.0022
Toxoplasma gondii histone lysine methyltransferase SET1 0.0058 0.0169 0.0621
Echinococcus granulosus dna polymerase eta 0.002 0.0046 0.0346
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0016 0.0014
Echinococcus multilocularis chromodomain helicase DNA binding protein 7 0.0012 0.0021 0.0156
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0004 0.0039
Trichomonas vaginalis lymphoid specific helicase, putative 0.0013 0.0023 0.0253
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0045 0.0163
Echinococcus granulosus snurportin 1 0.0317 0.1006 0.7493
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0035 0.0259
Echinococcus multilocularis BRK domain containing protein 0.0012 0.0021 0.0156
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0161 0.0221
Loa Loa (eye worm) hypothetical protein 0.0006 0.0003 0.0029
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0123 0.0447
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Plasmodium vivax helicase, putative 0.0006 0.0002 0.0005
Toxoplasma gondii hypothetical protein 0.0087 0.0264 0.0969
Schistosoma mansoni importin-beta 2 0.0006 0 0.0003
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.002 0.0046 0.0346
Schistosoma mansoni hypothetical protein 0.0175 0.0546 0.4065
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0102 0.0759
Echinococcus granulosus Smad4 0.0008 0.0009 0.0069
Echinococcus granulosus smad 0.0008 0.0009 0.0069
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0035 0.0127
Schistosoma mansoni Smad4 0.0008 0.0009 0.0069
Echinococcus multilocularis global transcription activator snf2l2 0.0069 0.0206 0.1531
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0078 0.0286
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0044 0.0123 0.0453
Brugia malayi kap beta 3 protein 0.0006 0 0.0001
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0011 0.0016
Brugia malayi nuclear hormone receptor 0.001 0.0016 0.0022
Leishmania major telomerase reverse transcriptase, putative 0.0848 0.2718 1
Trichomonas vaginalis helicase, putative 0.0007 0.0004 0.0039
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0087 0.0264 0.0969
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0016 0.0118
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Schistosoma mansoni hypothetical protein 0.0422 0.1343 1
Schistosoma mansoni hypothetical protein 0.0037 0.0102 0.0759
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0016 0.0022
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0311 0.0987 0.3625
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0035 0.0259
Echinococcus granulosus disco interacting protein 2 0.004 0.011 0.0822
Trypanosoma brucei DNA polymerase eta, putative 0.002 0.0046 0.0169
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0006 0.0002 0.0007
Leishmania major flap endonuclease-1 (FEN-1), putative 0.0027 0.0069 0.0252
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0012 0.0088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0161 0.1195
Echinococcus multilocularis BRK domain containing protein 0.0012 0.0021 0.0156
Trypanosoma brucei unspecified product 0.0014 0.0027 0.0096
Brugia malayi Associated with TFs and helicases family protein 0.0012 0.0021 0.0029
Echinococcus granulosus FTZ F1 alpha 0.001 0.0016 0.0118
Schistosoma mansoni coup transcription factor 0.001 0.0016 0.0118
Giardia lamblia DINP protein human, muc B family 0.002 0.0046 0.0163
Trichomonas vaginalis flap endonuclease-1, putative 0.0027 0.0069 0.0768
Loa Loa (eye worm) hypothetical protein 0.0006 0.0002 0.0022
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0161 0.1195
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0035 0.0127
Brugia malayi steroid hormone receptor 0.001 0.0016 0.0022
Schistosoma mansoni helicase 0.0006 0.0002 0.0013
Echinococcus multilocularis flap endonuclease 1 0.0027 0.0069 0.0513
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Loa Loa (eye worm) hypothetical protein 0.001 0.0016 0.0158
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0016 0.0118
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0006 0.0002 0.0007
Echinococcus multilocularis dna polymerase kappa 0.002 0.0046 0.0346
Schistosoma mansoni cpg binding protein 0.0064 0.0189 0.1409
Echinococcus multilocularis snurportin 1 0.0317 0.1006 0.7493
Toxoplasma gondii DNA methyltransferase 2, putative 0.002 0.0048 0.0175
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0016 0.0035 0.0127
Brugia malayi nuclear receptor NHR-88 0.001 0.0016 0.0022
Brugia malayi Muscleblind-like protein 0.0154 0.0479 0.066
Echinococcus granulosus muscleblind protein 0.0154 0.0479 0.3568
Schistosoma mansoni helicase 0.0006 0.0002 0.0013
Loa Loa (eye worm) hypothetical protein 0.001 0.0016 0.0158
Plasmodium vivax telomerase reverse transcriptase, putative 0.0848 0.2718 1
Echinococcus granulosus Chromo domain 0.0012 0.0021 0.0156
Loa Loa (eye worm) hypothetical protein 0.001 0.0016 0.0158
Brugia malayi CXXC zinc finger family protein 0.0064 0.0189 0.026
Echinococcus multilocularis smad 0.0008 0.0009 0.0069
Schistosoma mansoni terminal deoxycytidyl transferase 0.002 0.0046 0.0346
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0102 0.0759
Entamoeba histolytica hypothetical protein 0.0102 0.0311 0.2731
Echinococcus multilocularis disco interacting protein 2 0.004 0.011 0.0822
Schistosoma mansoni importin beta-1 0.003 0.0078 0.0582
Loa Loa (eye worm) isocitrate dehydrogenase 0.0016 0.0035 0.0346
Echinococcus multilocularis BRK domain 0.0012 0.0021 0.0156
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0046 0.0163
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0046 0.0169
Brugia malayi Telomerase reverse transcriptase 0.2256 0.7264 1
Onchocerca volvulus 0.004 0.011 0.0109
Toxoplasma gondii hypothetical protein 0.005 0.0144 0.0529
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0035 0.012
Brugia malayi MH1 domain containing protein 0.0008 0.0009 0.0013
Echinococcus multilocularis importin 5 0.0006 0 0.0003
Toxoplasma gondii RNA-directed DNA polymerase 0.0848 0.2718 1
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0016 0.0022
Brugia malayi Smad1 0.0008 0.0009 0.0013
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0016 0.0158
Entamoeba histolytica DNA (cytosine-5)-methyltransferase, putative 0.002 0.0048 0.0418
Trypanosoma brucei DNA damage repair protein, putative 0.0006 0.0002 0.0007
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0016 0.0022
Leishmania major DNA polymerase eta, putative 0.0006 0.0002 0.0007
Echinococcus multilocularis dna polymerase eta 0.002 0.0046 0.0346
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.002 0.0046 0.0461
Echinococcus granulosus transportin 1 0.0006 0 0.0003
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.002 0.0046 0.0169
Echinococcus multilocularis DNA methyltransferase 2, putative 0.002 0.0048 0.0357
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0016 0.0118
Plasmodium falciparum DEAD/DEAH box helicase, putative 0.0011 0.0017 0.0061
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.006 0.0669
Echinococcus granulosus Helicase SANT associated DNA binding 0.0006 0.0002 0.0013
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0045 0.0157
Echinococcus granulosus DNA methyltransferase 2, putative 0.002 0.0048 0.0357
Mycobacterium ulcerans DNA polymerase IV 0.002 0.0046 0.0498
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0311 0.0987 0.3625
Schistosoma mansoni cpg binding protein 0.0066 0.0195 0.145
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0044 0.0123 0.0447
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0027 0.0096
Trypanosoma brucei DNA polymerase kappa, putative 0.0006 0.0002 0.0007
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0016 0.0022
Schistosoma mansoni glutaminase 0.0282 0.0891 0.6639
Schistosoma mansoni smad 0.0008 0.0009 0.0069
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0016 0.0035 0.0259
Echinococcus granulosus geminin 0.0175 0.0546 0.4065
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Schistosoma mansoni thyroid hormone receptor 0.001 0.0016 0.0118
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0016 0.0158
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Toxoplasma gondii isocitrate dehydrogenase 0.0016 0.0035 0.0127
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0016 0.0158
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0016 0.0022
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0161 0.1195
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0016 0.0118
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0007 0.0006 0.0044
Echinococcus multilocularis BRK domain containing protein 0.0012 0.0021 0.0156
Loa Loa (eye worm) BRM protein 0.0044 0.0125 0.1241
Plasmodium vivax importin-beta 2, putative 0.003 0.0078 0.0286
Echinococcus multilocularis BRK domain containing protein 0.0012 0.0021 0.0156
Echinococcus granulosus mixed lineage leukemia protein mll 0.0007 0.0006 0.0044
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0016 0.0035 0.0127
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Brugia malayi Flap endonuclease-1 0.0027 0.0069 0.0095
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0016 0.0118
Echinococcus granulosus importin 5 0.0006 0 0.0003
Trichomonas vaginalis importin beta-1, putative 0.0024 0.006 0.0669
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0053 0.0154 0.056
Brugia malayi Importin beta-1 subunit 0.003 0.0078 0.0108
Brugia malayi isocitrate dehydrogenase 0.0016 0.0035 0.0048
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0063 0.0185 0.1377
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0016 0.0158
Loa Loa (eye worm) MH2 domain-containing protein 0.0123 0.0379 0.377
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0161 0.1195
Echinococcus granulosus importin subunit beta 1 0.003 0.0078 0.0582
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0045 0.039
Loa Loa (eye worm) hypothetical protein 0.001 0.0016 0.0158
Loa Loa (eye worm) hypothetical protein 0.0154 0.0479 0.4762
Echinococcus granulosus global transcription activator snf2l2 0.0069 0.0206 0.1531
Echinococcus multilocularis muscleblind protein 1 0.0154 0.0479 0.3568
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0045 0.0445
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0102 0.0759
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0027 0.0096
Brugia malayi Isocitrate dehydrogenase 0.0016 0.0035 0.0048
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0016 0.0158
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Toxoplasma gondii C-5 cytosine-specific DNA methylase superfamily protein 0.002 0.0048 0.0175
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0046 0.0169
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0009 0.0069
Entamoeba histolytica hypothetical protein 0.0037 0.0102 0.0892
Giardia lamblia DNA repair protein RAD52 0.0358 0.1139 0.4184
Mycobacterium tuberculosis Conserved hypothetical protein 0.0164 0.0511 1
Brugia malayi BRM protein 0.0069 0.0206 0.0283
Echinococcus multilocularis importin subunit beta 1 0.003 0.0078 0.0582
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0161 0.1195
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0147 0.0458 0.1682
Trypanosoma brucei flap endonuclease-1 (FEN-1), putative 0.0027 0.0069 0.0252
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Loa Loa (eye worm) hypothetical protein 0.001 0.0016 0.0158
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0045 0.0163
Echinococcus granulosus translational activator gcn1 0.0006 0 0.0003
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0046 0.0169
Leishmania major importin beta-1 subunit, putative 0.0024 0.006 0.0219
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0016 0.0022
Loa Loa (eye worm) SNF2 family domain-containing protein 0.0006 0.0002 0.0017
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0016 0.0035 0.0127
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0016 0.0022
Mycobacterium ulcerans hypothetical protein 0.0164 0.0511 0.5726
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0016 0.0158
Plasmodium falciparum Snf2-related CBP activator, putative 0.0006 0.0002 0.0005
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0004 0.0039
Trypanosoma brucei telomerase reverse transcriptase 0.0848 0.2718 1
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0009 0.0069
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0007 0.0006 0.0044
Brugia malayi MH2 domain containing protein 0.0008 0.0009 0.0013
Echinococcus multilocularis transportin 1 0.0006 0 0.0003
Trypanosoma brucei cytosine-specific DNA methylase, putative 0.002 0.0048 0.0175
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0078 0.0286
Schistosoma mansoni smad1 5 8 and 0.0008 0.0009 0.0069
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0016 0.0118
Schistosoma mansoni DNA polymerase IV / kappa 0.0006 0.0002 0.0016
Plasmodium falciparum importin beta, putative 0.003 0.0078 0.0286
Entamoeba histolytica Flap nuclease, putative 0.0027 0.0069 0.0602
Trypanosoma brucei chrX additional, unordered contigs 0.0006 0.0002 0.0007
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0161 0.1195
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0045 0.0334
Leishmania major DNA polymerase kappa, putative 0.002 0.0046 0.0169
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0147 0.0458 0.1677
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0009 0.0069
Entamoeba histolytica Rad52/22 family double-strand break repair protein, putative 0.0102 0.0311 0.2731
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0016 0.0022
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0016 0.0118
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0016 0.0022
Echinococcus multilocularis Helicase SANT associated, DNA binding 0.0006 0.0002 0.0013
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0016 0.0014
Treponema pallidum exodeoxyribonuclease (exoA) 0.0019 0.0045 0.5
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0016 0.0118
Loa Loa (eye worm) hypothetical protein 0.001 0.0016 0.0158
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0045 0.0498
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0016 0.0118
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0016 0.0118
Toxoplasma gondii exonuclease III APE 0.0019 0.0045 0.0163
Loa Loa (eye worm) hypothetical protein 0.0006 0.0002 0.0025
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Brugia malayi ecdysteroid receptor 0.001 0.0016 0.0022
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0012 0.0117
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0016 0.0022
Mycobacterium tuberculosis Conserved hypothetical protein 0.002 0.0046 0.0244
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0046 0.0163
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0046 0.0064
Giardia lamblia Flap structure-specific endonuclease 0.0027 0.0069 0.0246
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0045 0.021
Echinococcus multilocularis helicase 0.0006 0.0002 0.0013
Trypanosoma brucei DNA polymerase kappa, putative 0.0006 0.0002 0.0007
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0.0045 0.5
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0045 0.0062
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0016 0.0118
Plasmodium vivax DNA repair protein REV1, putative 0.0006 0.0002 0.0007
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0016 0.0022
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0046 0.0163
Entamoeba histolytica DNA repair and recombination protein RAD52, putative 0.0358 0.1139 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0006 0.0044
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.002 0.0046 0.0346
Trypanosoma brucei unspecified product 0.002 0.0046 0.0169
Schistosoma mansoni hypothetical protein 0.0014 0.0026 0.0196
Trypanosoma cruzi flap endonuclease-1 (FEN-1), putative 0.0027 0.0069 0.0246
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0044 0.0123 0.0447
Toxoplasma gondii SWI2/SNF2 Brahma-like putative 0.0011 0.0017 0.0061
Trichomonas vaginalis glutaminase, putative 0.0282 0.0891 1
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.006 0.0669
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0016 0.0158
Brugia malayi SNF2 family N-terminal domain containing protein 0.0006 0.0002 0.0002
Echinococcus granulosus dnaJ subfamily B 0.0422 0.1343 1
Loa Loa (eye worm) kap beta 3 protein 0.0006 0 0.0004
Entamoeba histolytica hypothetical protein 0.0037 0.0102 0.0892
Loa Loa (eye worm) flap endonuclease-1 0.0027 0.0069 0.0684
Brugia malayi RNA, U transporter 1 0.0085 0.0255 0.0351
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0147 0.0458 0.1682
Echinococcus granulosus helicase 0.0006 0.0002 0.0013
Echinococcus granulosus polybromo 1 0.0006 0.0003 0.0022
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0016 0.0118
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Loa Loa (eye worm) Smad1 0.0008 0.0009 0.0092
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0012 0.0088
Mycobacterium ulcerans glutaminase 0.0282 0.0891 1
Echinococcus multilocularis isocitrate dehydrogenase 0.0016 0.0035 0.0259
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.002 0.0046 0.0346
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0016 0.0118
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0004 0.0039
Schistosoma mansoni hypothetical protein 0.0006 0.0002 0.0013
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0006 0.0002 0.0007
Schistosoma mansoni DNA (cytosine-5)-methyltransferase 0.002 0.0048 0.0357
Echinococcus granulosus dna polymerase kappa 0.002 0.0046 0.0346
Plasmodium vivax hypothetical protein, conserved 0.0006 0.0002 0.0005
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0009 0.0092
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Loa Loa (eye worm) hypothetical protein 0.004 0.011 0.1097
Echinococcus multilocularis polybromo 1 0.0006 0.0003 0.0022
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Echinococcus multilocularis translational activator gcn1 0.0006 0 0.0003
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0016 0.0035 0.0259
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0161 0.1195
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0317 0.1006 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0004 0.0039
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0016 0.0035 0.0259
Entamoeba histolytica hypothetical protein 0.0024 0.006 0.0524
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0016 0.0118
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0045 0.0157
Mycobacterium ulcerans DNA polymerase IV 0.002 0.0046 0.0498
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0027 0.0096
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0016 0.0035 0.0127
Loa Loa (eye worm) glutaminase 0.0282 0.0891 0.8861
Trypanosoma cruzi telomerase reverse transcriptase, putative 0.0848 0.2718 1
Schistosoma mansoni DNA polymerase eta 0.002 0.0046 0.0346
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0016 0.0014
Giardia lamblia Telomerase catalytic subunit 0.0848 0.2718 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0016 0.0118
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0016 0.0022
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0045 0.0479
Plasmodium falciparum flap endonuclease 1 0.0027 0.0069 0.0252
Loa Loa (eye worm) hypothetical protein 0.0154 0.0479 0.4762
Loa Loa (eye worm) transcription factor SMAD2 0.0123 0.0379 0.377
Loa Loa (eye worm) hypothetical protein 0.001 0.0016 0.0158
Brugia malayi glutaminase DH11.1 0.0282 0.0891 0.1227
Brugia malayi hypothetical protein 0.0037 0.0102 0.014
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0016 0.0118
Leishmania major DNA damage repair protein, putative 0.0006 0.0002 0.0007
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0078 0.0286
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0311 0.0987 0.3629
Brugia malayi MH2 domain containing protein 0.0123 0.0379 0.0522
Entamoeba histolytica hypothetical protein 0.0037 0.0102 0.0892
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0016 0.0118
Schistosoma mansoni smad1 5 8 and 0.0008 0.0009 0.0069
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0045 0.0334
Schistosoma mansoni ap endonuclease 0.0019 0.0045 0.0334
Loa Loa (eye worm) CXXC zinc finger family protein 0.0064 0.0189 0.1881
Plasmodium vivax DNA (cytosine-5)-methyltransferase, putative 0.002 0.0048 0.0175
Brugia malayi Disco-interacting protein 2 homolog 0.004 0.011 0.0152
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0016 0.0118
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.006 0.0213
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0016 0.0118
Echinococcus granulosus flap endonuclease 1 0.0027 0.0069 0.0513
Schistosoma mansoni disco-interacting protein 2 (dip2) 0.004 0.011 0.0822
Onchocerca volvulus 0.001 0.0016 0.0014
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0016 0.0118
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Leishmania major modification methylase-like protein 0.002 0.0048 0.0175
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0016 0.0022
Leishmania major DNA polymerase eta, putative 0.002 0.0046 0.0169
Loa Loa (eye worm) hypothetical protein 0.001 0.0016 0.0158
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0004 0.0039
Echinococcus multilocularis muscleblind protein 0.0154 0.0479 0.3568
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0004 0.0039
Schistosoma mansoni nuclear hormone receptor 0.001 0.0016 0.0118
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0016 0.0035 0.012
Loa Loa (eye worm) glutaminase 2 0.0282 0.0891 0.8861
Schistosoma mansoni flap endonuclease-1 0.0024 0.0061 0.0451
Trypanosoma brucei hypothetical protein, conserved 0.0006 0.0002 0.0007
Echinococcus granulosus BRK domain containing protein 0.0012 0.0021 0.0156
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0009 0.0092
Echinococcus multilocularis geminin 0.0175 0.0546 0.4065
Trypanosoma brucei DNA damage repair protein, putative 0.0006 0.0002 0.0007
Echinococcus multilocularis Chromo domain 0.0012 0.0021 0.0156
Brugia malayi SET domain containing protein 0.0007 0.0005 0.0006
Schistosoma mansoni thyroid hormone receptor 0.001 0.0016 0.0118
Brugia malayi polybromodomain protein 0.0006 0.0003 0.0004
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.002 0.0046 0.0517
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0045 0.0163
Loa Loa (eye worm) BRM protein 0.0036 0.0098 0.0972
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0004 0.0039
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.002 0.0046 0.0244
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0016 0.0118
Leishmania major DNA polymerase kappa, putative 0.0006 0.0002 0.0007
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0009 0.0069
Schistosoma mansoni hypothetical protein 0.0317 0.1006 0.7493
Schistosoma mansoni ap endonuclease 0.0019 0.0045 0.0334
Schistosoma mansoni helicase 0.0069 0.0206 0.1531
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0016 0.0118
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0016 0.0035 0.0259
Plasmodium vivax flap endonuclease 1, putative 0.0027 0.0069 0.0252
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0046 0.0169
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0016 0.0118
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0007 0.0006 0.0044
Brugia malayi polk-prov protein 0.0006 0.0002 0.0003
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0045 0.0163
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0045 0.0157
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0004 0.0039
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0016 0.0158
Entamoeba histolytica hypothetical protein 0.0037 0.0102 0.0892
Brugia malayi MH2 domain containing protein 0.0008 0.0009 0.0013
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0161 0.1595
Schistosoma mansoni hypothetical protein 0.0175 0.0546 0.4065
Schistosoma mansoni cpg binding protein 0.0066 0.0195 0.145
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0016 0.0118
Plasmodium falciparum DNA (cytosine-5)-methyltransferase 0.002 0.0048 0.0175
Loa Loa (eye worm) helicase DNA-binding protein 0.0012 0.0021 0.0208
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0004 0.0039
Loa Loa (eye worm) importin-beta domain-containing protein 0.0006 0 0.0004

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 7.9433 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.6891 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 18.526 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 19.9526 uM PubChem BioAssay. qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 20.5878 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 112.2018 uM PubChem BioAssay. Inhibitors of Secretory Acid Sphingomyelinase (S-ASM): qHTS. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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

Annotated phenotypes:

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

Bibliographic References

No literature references available for this target.

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