Detailed information for compound 1588054

Basic information

Technical information
  • TDR Targets ID: 1588054
  • Name: 2-(4-methoxyphenyl)-N-pyridin-3-ylacetamide
  • MW: 242.273 | Formula: C14H14N2O2
  • H donors: 1 H acceptors: 2 LogP: 1.59 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)CC(=O)Nc1cccnc1
  • InChi: 1S/C14H14N2O2/c1-18-13-6-4-11(5-7-13)9-14(17)16-12-3-2-8-15-10-12/h2-8,10H,9H2,1H3,(H,16,17)
  • InChiKey: MQUBBMQYRRRRDN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-(4-methoxyphenyl)-N-(3-pyridyl)acetamide
  • 2-(4-methoxyphenyl)-N-pyridin-3-yl-ethanamide
  • ZINC00304658
  • Oprea1_850750
  • Oprea1_392773
  • STK179338
  • MLS001183380
  • SMR000502531

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ataxin 2 Starlite/ChEMBL No references

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 protein phosphatase-1 0.0019 0.003 0.0056
Toxoplasma gondii hypothetical protein 0.0094 0.0496 0.1852
Loa Loa (eye worm) multisynthetase complex auxiliary component p43 0.0164 0.0924 0.1662
Schistosoma mansoni hypothetical protein 0.0044 0.0188 0.0346
Mycobacterium ulcerans hypothetical protein 0.0039 0.0156 0.7956
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0138 0.0766 0.1408
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0022 0.0051 0.0099
Mycobacterium tuberculosis Probable DNA polymerase III (alpha chain) DnaE2 (DNA nucleotidyltransferase) 0.0044 0.0188 0.1111
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0185 0.1055 0.1055
Trichomonas vaginalis esterase, putative 0.0039 0.0156 0.024
Echinococcus multilocularis replication protein A 70 kDa DNA binding 0.0897 0.5439 0.5439
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0156 0.024
Mycobacterium ulcerans methionyl-tRNA synthetase 0.0031 0.0107 0.4838
Mycobacterium tuberculosis Conserved protein 0.0039 0.0156 0.0884
Loa Loa (eye worm) hypothetical protein 0.0039 0.0156 0.0244
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0156 0.024
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.01 0.0291
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0185 0.1055 0.194
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0199 0.1139 0.2094
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0107 0.0301
Leishmania major serine/threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0019 0.0031 0.0019
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0056 0.0263 0.0483
Schistosoma mansoni hypothetical protein 0.0304 0.179 0.3291
Trichomonas vaginalis ran, putative 0.0022 0.0051 0.0047
Trypanosoma brucei protein phosphatase 1, putative 0.003 0.01 0.0292
Mycobacterium tuberculosis Methionyl-tRNA synthetase MetS (MetRS) (methionine--tRNA ligase) 0.0031 0.0107 0.0538
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0022 0.0051 0.0082
Echinococcus multilocularis lysyl tRNA synthetase 0.0044 0.0188 0.0188
Loa Loa (eye worm) bifunctional aminoacyl-tRNA synthetase 0.0151 0.0847 0.152
Schistosoma mansoni apoptosis regulator bax 0.0138 0.0766 0.1408
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0022 0.0051 0.0051
Trypanosoma brucei serine threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Brugia malayi Serine/threonine protein phosphatase PP1 isozyme 1, putative 0.0019 0.003 0.0015
Schistosoma mansoni ran 0.0022 0.0051 0.0094
Leishmania major aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Schistosoma mansoni cpg binding protein 0.006 0.0285 0.0524
Mycobacterium tuberculosis Probable esterase LipL 0.0039 0.0156 0.0884
Echinococcus multilocularis serine:threonine protein phosphatase PP1 isozyme 0.003 0.01 0.01
Plasmodium falciparum aspartate--tRNA ligase 0.0044 0.0188 0.0623
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0103 0.0305
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.022 0.0405
Echinococcus granulosus snurportin 1 0.0319 0.1881 0.3458
Echinococcus granulosus dnaJ subfamily B 0.0807 0.489 0.899
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0249 0.145 1
Toxoplasma gondii methionyl-tRNA synthetase 0.0031 0.0107 0.0318
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0103 0.0288
Toxoplasma gondii replication factor-a protein 1 (rpa1) subfamily protein 0.043 0.2563 1
Loa Loa (eye worm) serine/threonine protein phosphatase PP1 isozyme 1 0.0019 0.003 0.0012
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Loa Loa (eye worm) hypothetical protein 0.0039 0.0156 0.0244
Echinococcus granulosus polycomb protein SCMH1 0.0049 0.022 0.0405
Echinococcus granulosus serine:threonine protein phosphatase PP1 gamma 0.003 0.01 0.0184
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0025 0.0067 0.0162
Plasmodium vivax methionine--tRNA ligase, putative 0.0031 0.0107 0.0301
Brugia malayi hypothetical protein 0.002 0.0037 0.0027
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0021 0.0046 0.0079
Loa Loa (eye worm) phosphatidylinositol 3 0.0018 0.0026 0.0004
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0022 0.0051 0.0053
Brugia malayi Serine/threonine protein phosphatase F56C9.1 in chromosomeIII 0.003 0.01 0.0143
Entamoeba histolytica methionyl-tRNA synthetase, putative 0.0195 0.1115 0.4808
Echinococcus granulosus GTP binding nuclear protein Ran 0.0022 0.0051 0.0094
Loa Loa (eye worm) methionyl-tRNA synthetase 0.0031 0.0107 0.0153
Mycobacterium tuberculosis Probable lipase LipE 0.0039 0.0156 0.0884
Trypanosoma cruzi serine/threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Loa Loa (eye worm) hypothetical protein 0.003 0.0103 0.0147
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0051 0.0099
Echinococcus granulosus methionyl tRNA synthetase cytoplasmic 0.0195 0.1115 0.205
Trichomonas vaginalis D-aminoacylase, putative 0.0039 0.0156 0.024
Schistosoma mansoni lysyl-tRNA synthetase 0.0044 0.0188 0.0346
Loa Loa (eye worm) replication factor A 73 kDa subunit 0.0897 0.5439 1
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0056 0.0263 0.0443
Trypanosoma cruzi hypothetical protein, conserved 0.0044 0.0188 0.0639
Schistosoma mansoni glycyl-tRNA synthetase 0.0151 0.0847 0.1558
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0199 0.1139 0.1139
Entamoeba histolytica hypothetical protein 0.0025 0.0067 0.0182
Echinococcus multilocularis cpg binding protein 0.006 0.0285 0.0285
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0774 0.4682 0.8609
Toxoplasma gondii tRNA ligases class I (M) protein 0.0031 0.0107 0.0318
Entamoeba histolytica replication factor A protein 1, putative 0.0386 0.2291 1
Echinococcus multilocularis histone acetyltransferase MYST2 0.0056 0.0263 0.0263
Echinococcus granulosus histone acetyltransferase MYST2 0.0056 0.0263 0.0483
Trichomonas vaginalis serine/threonine protein phosphatase, putative 0.0019 0.003 0.0008
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0051 0.0099
Schistosoma mansoni replication factor A 1 rfa1 0.0897 0.5439 1
Toxoplasma gondii exonuclease III APE 0.0019 0.0031 0.0017
Entamoeba histolytica replication factor A, putative 0.0087 0.0451 0.1877
Loa Loa (eye worm) hypothetical protein 0.0087 0.0451 0.0789
Echinococcus multilocularis protein phosphatase 1 catalytic subunit 0.003 0.01 0.01
Trichomonas vaginalis protein phosphatase, caeel, putative 0.003 0.01 0.0137
Leishmania major serine/threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Echinococcus multilocularis serine:threonine protein phosphatase PP1 beta 0.003 0.01 0.01
Entamoeba histolytica asparaginyl-tRNA synthetase, putative 0.0044 0.0188 0.0716
Trypanosoma cruzi aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Treponema pallidum aspartyl-tRNA synthetase 0.0044 0.0188 0.1455
Loa Loa (eye worm) 63kd antigen 0.0044 0.0188 0.0303
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0025 0.0067 0.0083
Leishmania major phosphatidylinositol kinase related protein, putative 0.0018 0.0026 0.0001
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0774 0.4682 0.4682
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0039 0.0156 0.7956
Schistosoma mansoni myelin transcription factor 1 myt1 0.0056 0.0263 0.0483
Echinococcus granulosus methionine tRNA synthetase 0.0031 0.0107 0.0196
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0049 0.022 0.0137
Brugia malayi lysyl-tRNA synthetase 0.0044 0.0188 0.0306
Loa Loa (eye worm) hypothetical protein 0.0138 0.0766 0.137
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0018 0.0026 0.0048
Trichomonas vaginalis replication factor A 1, rfa1, putative 0.0852 0.5167 0.9497
Mycobacterium ulcerans leucyl-tRNA synthetase 0.0031 0.0107 0.4838
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0044 0.0188 0.03
Schistosoma mansoni ataxia telangiectasia mutated (atm) 0.0025 0.0067 0.0124
Loa Loa (eye worm) serine/threonine protein phosphatase PP1 isozyme 1 0.0019 0.003 0.0012
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0065 0.0072
Echinococcus granulosus beta LACTamase domain containing family member 0.0039 0.0156 0.0287
Chlamydia trachomatis lysine--tRNA ligase 0.0044 0.0188 0.0808
Loa Loa (eye worm) hypothetical protein 0.0031 0.0107 0.0153
Echinococcus granulosus lysyl tRNA synthetase 0.0044 0.0188 0.0346
Trypanosoma cruzi Replication factor A protein 1 0.043 0.2563 1
Schistosoma mansoni protein phosphatase type 1 0.003 0.01 0.0184
Wolbachia endosymbiont of Brugia malayi methionyl-tRNA synthetase 0.0031 0.0107 0.4838
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0039 0.0156 0.0244
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0022 0.0051 0.0082
Loa Loa (eye worm) hypothetical protein 0.0019 0.003 0.0012
Schistosoma mansoni hypothetical protein 0.0138 0.0766 0.1408
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0031 0.0008
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0044 0.0188 1
Leishmania major replication factor A, 51kDa subunit, putative 0.043 0.2563 1
Loa Loa (eye worm) hypothetical protein 0.0039 0.0156 0.0244
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0103 0.0305
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0014 0.0003 0.0005
Loa Loa (eye worm) beta-lactamase 0.0039 0.0156 0.0244
Echinococcus multilocularis importin subunit beta 1 0.003 0.01 0.01
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0065 0.0154
Echinococcus granulosus serine:threonine protein phosphatase PP1 gamma 0.003 0.01 0.0184
Toxoplasma gondii OB-fold nucleic acid binding domain-containing protein 0.0225 0.1304 0.5036
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0031 0.0017
Brugia malayi mbt repeat family protein 0.0049 0.022 0.0365
Toxoplasma gondii histone lysine methyltransferase SET1 0.0107 0.0578 0.2173
Trypanosoma cruzi phosphatidylinositol kinase related protein, putative 0.0018 0.0026 0.0001
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0319 0.1881 0.3429
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Trypanosoma brucei serine threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Onchocerca volvulus Putative replication factor A 73 kDa subunit 0.0802 0.4859 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0156 0.024
Brugia malayi Serine/threonine protein phosphatase PP1 isozyme 1, putative 0.0019 0.003 0.0015
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Toxoplasma gondii ABC1 family protein 0.0039 0.0156 0.0512
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0019 0.0031 0.0063
Toxoplasma gondii aspartate-tRNA ligase 0.0044 0.0188 0.0639
Schistosoma mansoni protein phosphatase-1 0.003 0.01 0.0184
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0044 0.0188 1
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0018 0.0026 0.0048
Giardia lamblia Lysyl-tRNA synthetase 0.0044 0.0188 0.2325
Echinococcus multilocularis asparaginyl tRNA synthetase, cytoplasmic 0.0044 0.0188 0.0188
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0049 0.022 0.0405
Echinococcus multilocularis asparaginyl tRNA synthetase 0.0044 0.0188 0.0188
Mycobacterium leprae Probable lipase LipE 0.0039 0.0156 0.6039
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0065 0.0072
Trypanosoma brucei serine threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0103 0.0305
Schistosoma mansoni sex comb on midleg homolog 0.0049 0.022 0.0405
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0031 0.0017
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0156 0.0512
Trypanosoma cruzi aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0103 0.0288
Loa Loa (eye worm) hypothetical protein 0.003 0.01 0.014
Plasmodium vivax replication protein A1, large subunit, putative 0.043 0.2563 1
Loa Loa (eye worm) aspartyl-tRNA synthetase 0.0044 0.0188 0.0303
Trypanosoma cruzi asparaginyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Trichomonas vaginalis protein phosphatase-1, putative 0.0019 0.003 0.0008
Trichomonas vaginalis protein phosphatase-1, putative 0.0019 0.003 0.0008
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0138 0.0766 0.0766
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0185 0.1055 0.1055
Mycobacterium ulcerans aspartyl-tRNA synthetase 0.0044 0.0188 1
Plasmodium vivax aspartate--tRNA ligase, putative 0.0044 0.0188 0.0623
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0022 0.0051 0.0099
Loa Loa (eye worm) hypothetical protein 0.003 0.01 0.0141
Loa Loa (eye worm) serine/threonine protein phosphatase PP1-alpha catalytic subunit 0.0019 0.003 0.0012
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0039 0.0156 0.0246
Trichomonas vaginalis replication factor A 1, rfa1, putative 0.0897 0.5439 1
Trichomonas vaginalis replication factor A 1, rfa1, putative 0.043 0.2563 0.4687
Echinococcus granulosus glycyl tRNA synthetase 0.0151 0.0847 0.1558
Onchocerca volvulus Putative replication factor A 73 kDa subunit 0.0087 0.0451 0.0628
Loa Loa (eye worm) serine/threonine protein phosphatase PP1-beta catalytic subunit 0.003 0.01 0.0141
Plasmodium vivax asparagine--tRNA ligase, putative 0.0044 0.0188 0.0623
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0056 0.0263 0.0263
Echinococcus multilocularis dnaJ subfamily B 0.0807 0.489 0.489
Echinococcus multilocularis methionine tRNA synthetase 0.0031 0.0107 0.0107
Mycobacterium tuberculosis Probable hydrolase 0.0039 0.0156 0.0884
Schistosoma mansoni protein phosphatase type 1 0.0019 0.003 0.0056
Plasmodium falciparum lysine--tRNA ligase 0.0044 0.0188 0.0623
Loa Loa (eye worm) apoptosis regulator protein 0.0138 0.0766 0.137
Brugia malayi Serine/threonine protein phosphatase PP1-alpha catalytic subunit 0.0019 0.003 0.0015
Brugia malayi beta-lactamase 0.0039 0.0156 0.0246
Echinococcus granulosus serine protein kinase ATM 0.0025 0.0067 0.0124
Brugia malayi Aspartyl-tRNA synthetase 0.0044 0.0188 0.0306
Loa Loa (eye worm) hypothetical protein 0.0039 0.0156 0.0244
Schistosoma mansoni hypothetical protein 0.0138 0.0766 0.1408
Toxoplasma gondii lysine-tRNA ligase 0.0044 0.0188 0.0639
Leishmania major aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0022 0.0051 0.0051
Mycobacterium tuberculosis Conserved protein 0.0039 0.0156 0.0884
Chlamydia trachomatis methionine--tRNA ligase 0.0195 0.1115 1
Trypanosoma brucei protein phosphatase 1 0.0019 0.003 0.0017
Plasmodium vivax hypothetical protein, conserved 0.0039 0.0156 0.0495
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0039 0.0156 0.0884
Trypanosoma cruzi serine/threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Treponema pallidum leucyl-tRNA synthetase 0.0031 0.0107 0.0704
Echinococcus granulosus phosphatidylinositol 3 and 4 kinase 0.0018 0.0026 0.0048
Trypanosoma brucei phosphatidylinositol kinase related protein, putative 0.0025 0.0067 0.0162
Loa Loa (eye worm) hypothetical protein 0.0039 0.0156 0.0244
Schistosoma mansoni ap endonuclease 0.0019 0.0031 0.0056
Plasmodium falciparum serine/threonine protein phosphatase PP1 0.003 0.01 0.0275
Schistosoma mansoni hypothetical protein 0.0319 0.1881 0.3458
Schistosoma mansoni cpg binding protein 0.0057 0.0265 0.0487
Brugia malayi replication factor A 73 kDa subunit 0.0897 0.5439 1
Toxoplasma gondii serine/threonine phosophatase PP1 0.003 0.01 0.0292
Schistosoma mansoni mixed-lineage leukemia protein mll 0.012 0.0657 0.1207
Trichomonas vaginalis bsu-protein phosphatase, putative 0.003 0.01 0.0137
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0018 0.0026 0.0026
Onchocerca volvulus 0.0057 0.0265 0.0232
Schistosoma mansoni protein phosphatase type 1 0.003 0.01 0.0184
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0044 0.0188 0.0623
Schistosoma mansoni leucyl-tRNA synthetase 0.0031 0.0107 0.0196
Echinococcus multilocularis methionyl tRNA synthetase, cytoplasmic 0.0195 0.1115 0.1115
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0185 0.1055 0.194
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0039 0.0156 0.0884
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0018 0.0024 0.0024
Trichomonas vaginalis serine/threonine protein phosphatase, putative 0.003 0.01 0.0137
Echinococcus multilocularis polycomb protein SCMH1 0.0049 0.022 0.022
Leishmania major lysyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0065 0.0072
Plasmodium falciparum methionine--tRNA ligase 0.0031 0.0107 0.0301
Schistosoma mansoni cpg binding protein 0.006 0.0285 0.0524
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0018 0.0026 0.0007
Trichomonas vaginalis serine/threonine protein phosphatase, putative 0.0019 0.003 0.0008
Echinococcus granulosus protein phosphatase 1, catalytic subunit, beta isozyme 0.003 0.01 0.0184
Trichomonas vaginalis bsu-protein phosphatase, putative 0.003 0.01 0.0137
Trypanosoma cruzi serine/threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Schistosoma mansoni hypothetical protein 0.0807 0.489 0.899
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.01 0.0291
Echinococcus multilocularis serine:threonine protein phosphatase PP1 gamma 0.003 0.01 0.01
Leishmania major GTP-binding protein, putative 0.0022 0.0051 0.0099
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Plasmodium vivax lysine--tRNA ligase, putative 0.0044 0.0188 0.0623
Echinococcus granulosus protein phosphatase 1 catalytic subunit 0.003 0.01 0.0184
Echinococcus granulosus aspartyl tRNA synthetase cytoplasmic 0.0044 0.0188 0.0346
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Leishmania major lysyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Brugia malayi beta-lactamase family protein 0.0039 0.0156 0.0246
Trypanosoma brucei aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Schistosoma mansoni protein phosphatase-1 0.003 0.01 0.0184
Brugia malayi methionyl-tRNA synthetase 0.0031 0.0107 0.0156
Trypanosoma cruzi methionyl-tRNA synthetase, putative 0.0031 0.0107 0.0318
Brugia malayi Importin beta-1 subunit 0.003 0.01 0.0143
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0014 0.0003 0.0005
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0031 0.0017
Trypanosoma brucei aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Entamoeba histolytica Ran family GTPase 0.0022 0.0051 0.0111
Echinococcus multilocularis SAM and MBT domain containing protein 0.0049 0.022 0.022
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0185 0.1055 0.194
Plasmodium falciparum methionine--tRNA ligase, putative 0.0031 0.0107 0.0301
Loa Loa (eye worm) hypothetical protein 0.0195 0.1115 0.2015
Loa Loa (eye worm) hypothetical protein 0.0031 0.0107 0.0153
Leishmania major leucyl-tRNA synthetase, putative 0.0031 0.0107 0.0318
Leishmania major hypothetical protein, conserved 0.003 0.0103 0.0305
Plasmodium vivax importin-beta 2, putative 0.003 0.01 0.0274
Trichomonas vaginalis aspartyl/lysyl-tRNA synthetase, putative 0.0044 0.0188 0.03
Brugia malayi Asparaginyl-tRNA synthetase, cytoplasmic 0.0044 0.0188 0.0306
Trypanosoma cruzi aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Brugia malayi beta-lactamase family protein 0.0039 0.0156 0.0246
Mycobacterium ulcerans lipase LipD 0.0039 0.0156 0.7956
Brugia malayi putative serine/threonine phosphatase 0.0019 0.003 0.0015
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0031 0.0008
Echinococcus multilocularis beta LACTamase domain containing family member 0.0039 0.0156 0.0156
Giardia lamblia Hypothetical protein 0.0131 0.0724 1
Echinococcus granulosus asparaginyl tRNA synthetase cytoplasmic 0.0044 0.0188 0.0346
Plasmodium falciparum nucleic acid binding protein, putative 0.0044 0.0188 0.0623
Brugia malayi methionyl-tRNA synthetase 0.0195 0.1115 0.2017
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0185 0.1055 0.1904
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0031 0.0015
Trypanosoma cruzi hypothetical protein, conserved 0.0039 0.0156 0.0512
Trypanosoma brucei asparaginyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Giardia lamblia Ser/Thr protein phosphatase PP1-alpha 2 catalytic subunit 0.003 0.01 0.1063
Trypanosoma cruzi aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Echinococcus granulosus SAM and MBT domain containing protein 0.0049 0.022 0.0405
Schistosoma mansoni protein phosphatase-1 0.0019 0.003 0.0056
Trypanosoma cruzi serine/threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Trypanosoma cruzi aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0138 0.0766 0.1408
Entamoeba histolytica hypothetical protein 0.0044 0.0188 0.0716
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0014 0.0003 0.0003
Mycobacterium tuberculosis Probable lipase LipD 0.0039 0.0156 0.0884
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0031 0.0017
Trichomonas vaginalis replication factor A 1, rfa1, putative 0.0897 0.5439 1
Schistosoma mansoni ran 0.0022 0.0051 0.0094
Loa Loa (eye worm) serine/threonine protein phosphatase PP1-alpha catalytic subunit 0.0019 0.003 0.0012
Brugia malayi protein ZK524.3 0.0031 0.0107 0.0156
Echinococcus multilocularis glycyl tRNA synthetase 0.0151 0.0847 0.0847
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0156 0.0287
Plasmodium vivax asparagine--tRNA ligase, putative 0.0044 0.0188 0.0623
Echinococcus granulosus replication protein A 70 kDa DNA binding 0.0897 0.5439 1
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0031 0.0012
Plasmodium falciparum importin beta, putative 0.003 0.01 0.0274
Echinococcus granulosus asparaginyl tRNA synthetase, cytoplasmic 0.0044 0.0188 0.0346
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0103 0.0288
Echinococcus granulosus serine:threonine protein phosphatase PP1 beta 0.003 0.01 0.0184
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0151 0.0847 0.1523
Trichomonas vaginalis bsu-protein phosphatase, putative 0.0019 0.003 0.0008
Brugia malayi BRCA2 repeat family protein 0.0181 0.1031 0.1862
Trichomonas vaginalis PIKK family atypical protein kinase 0.0025 0.0067 0.0076
Loa Loa (eye worm) hypothetical protein 0.0021 0.0046 0.0041
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0018 0.0024 0.0044
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0185 0.1055 0.1907
Echinococcus granulosus cpg binding protein 0.006 0.0285 0.0524
Mycobacterium leprae conserved hypothetical protein 0.0039 0.0156 0.6039
Leishmania major methionyl-tRNA synthetase, putative 0.0031 0.0107 0.0318
Leishmania major importin beta-1 subunit, putative 0.0024 0.0065 0.0154
Plasmodium vivax serine/threonine protein phosphatase PP1, putative 0.003 0.01 0.0275
Trypanosoma brucei Replication factor A protein 1 0.043 0.2563 1
Echinococcus multilocularis leucyl tRNA synthetase 0.0031 0.0107 0.0107
Trypanosoma brucei methionyl-tRNA synthetase, putative 0.0031 0.0107 0.0318
Treponema pallidum methionyl-tRNA synthetase 0.0195 0.1115 1
Echinococcus granulosus importin subunit beta 1 0.003 0.01 0.0184
Loa Loa (eye worm) CXXC zinc finger family protein 0.0057 0.0265 0.0445
Mycobacterium ulcerans esterase/lipase LipP 0.0039 0.0156 0.7956
Trypanosoma cruzi replication Factor A 28 kDa subunit, putative 0.0044 0.0188 0.0639
Loa Loa (eye worm) MBCTL1 0.0056 0.0263 0.0441
Loa Loa (eye worm) serine/threonine protein phosphatase PP1-gamma catalytic subunit 0.0019 0.003 0.0012
Loa Loa (eye worm) hypothetical protein 0.0044 0.0188 0.0303
Giardia lamblia Asparaginyl-tRNA synthetase 0.0044 0.0188 0.2325
Loa Loa (eye worm) mbt repeat family protein 0.0049 0.022 0.0363
Loa Loa (eye worm) hypothetical protein 0.0056 0.0263 0.0441
Toxoplasma gondii FATC domain-containing protein 0.0025 0.0067 0.0162
Brugia malayi mbt repeat family protein 0.0049 0.022 0.0365
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0103 0.0305
Wolbachia endosymbiont of Brugia malayi leucyl-tRNA synthetase 0.0031 0.0107 0.4838
Trichomonas vaginalis methionine-tRNA synthetase, putative 0.0031 0.0107 0.0149
Giardia lamblia Aspartyl-tRNA synthetase 0.0044 0.0188 0.2325
Trichomonas vaginalis protein phosphatase, caeel, putative 0.0019 0.003 0.0008
Entamoeba histolytica hypothetical protein 0.0044 0.0188 0.0716
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0014 0.0003 0.0003
Trichomonas vaginalis protein phosphatase-1, putative 0.003 0.01 0.0137
Brugia malayi hypothetical protein 0.003 0.0103 0.0149
Plasmodium vivax methionine--tRNA ligase, putative 0.0031 0.0107 0.0301
Loa Loa (eye worm) BRCA2 repeat family protein 0.0181 0.1031 0.186
Loa Loa (eye worm) hypothetical protein 0.0039 0.0156 0.0244
Trypanosoma brucei hypothetical protein, conserved 0.0039 0.0156 0.0512
Chlamydia trachomatis aspartate--tRNA(Asp/Asn) ligase 0.0044 0.0188 0.0808
Loa Loa (eye worm) hypothetical protein 0.0049 0.022 0.0363
Echinococcus multilocularis aspartyl tRNA synthetase, cytoplasmic 0.0044 0.0188 0.0188
Schistosoma mansoni phosphatidylinositol 3-and 4-kinase 0.0018 0.0026 0.0048
Entamoeba histolytica hypothetical protein 0.0024 0.0065 0.0172
Brugia malayi CXXC zinc finger family protein 0.0057 0.0265 0.0448
Plasmodium falciparum asparagine--tRNA ligase 0.0044 0.0188 0.0623
Schistosoma mansoni methionine-tRNA synthetase 0.0195 0.1115 0.205
Brugia malayi Serine/threonine protein phosphatase PP1-beta catalytic subunit 0.003 0.01 0.0143
Mycobacterium tuberculosis Conserved protein 0.0039 0.0156 0.0884
Loa Loa (eye worm) glycyl-tRNA synthetase 0.0151 0.0847 0.152
Schistosoma mansoni methionine-tRNA synthetase 0.0031 0.0107 0.0196
Trichomonas vaginalis bsu-protein phosphatase, putative 0.003 0.01 0.0137
Leishmania major hypothetical protein, conserved 0.0039 0.0156 0.0512
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0185 0.1055 0.194
Brugia malayi RNA, U transporter 1 0.0085 0.0439 0.0769
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0044 0.0188 1
Entamoeba histolytica serine/threonine protein phosphatase PP1, putative 0.0019 0.003 0.0019
Plasmodium falciparum asparagine--tRNA ligase 0.0044 0.0188 0.0623
Leishmania major serine/threonine protein phosphatase catalytic subunit, putative 0.003 0.01 0.0292
Trichomonas vaginalis protein phosphatase-5, putative 0.0019 0.003 0.0008
Echinococcus multilocularis serine protein kinase ATM 0.0025 0.0067 0.0067
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Echinococcus multilocularis serine:threonine protein phosphatase PP1 gamma 0.003 0.01 0.01
Giardia lamblia Leucyl-tRNA synthetase 0.0031 0.0107 0.1157
Entamoeba histolytica aspartyl-tRNA synthetase, putative 0.0044 0.0188 0.0716
Wolbachia endosymbiont of Brugia malayi aspartyl-tRNA synthetase 0.0044 0.0188 1
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0039 0.0156 0.0884
Trypanosoma cruzi serine/threonine-protein phosphatase PP1 alpha 0.0019 0.003 0.0017
Leishmania major asparaginyl-tRNA synthetase, putative 0.0044 0.0188 0.0639
Onchocerca volvulus 0.0049 0.022 0.0137
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Leishmania major serine/threonine protein phosphatase pp1(5.9), putative 0.0019 0.003 0.0017
Brugia malayi glycyl-tRNA synthetase 0.0151 0.0847 0.1523
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0039 0.0156 0.0287
Schistosoma mansoni hypothetical protein 0.0138 0.0766 0.1408
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0018 0.0026 0.0007
Leishmania major serine/threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Giardia lamblia Methionyl-tRNA synthetase 0.0031 0.0107 0.1157
Mycobacterium tuberculosis Probable DNA polymerase III (alpha chain) DnaE1 (DNA nucleotidyltransferase) 0.0044 0.0188 0.1111
Leishmania major serine/threonine-protein phosphatase PP1, putative 0.0019 0.003 0.0017
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.01 0.0291
Echinococcus multilocularis snurportin 1 0.0319 0.1881 0.1881
Brugia malayi Serine/threonine protein phosphatase PP1-gamma catalytic subunit 0.0019 0.003 0.0015
Echinococcus multilocularis asparaginyl tRNA synthetase, cytoplasmic 0.0044 0.0188 0.0188
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0138 0.0766 0.1372
Plasmodium falciparum replication protein A1, large subunit 0.043 0.2563 1
Schistosoma mansoni lysyl-tRNA synthetase 0.0044 0.0188 0.0346
Mycobacterium ulcerans beta-lactamase 0.0039 0.0156 0.7956
Schistosoma mansoni ap endonuclease 0.0019 0.0031 0.0056
Loa Loa (eye worm) phosphatidylinositol 3 0.0018 0.0026 0.0004
Echinococcus multilocularis phosphatidylinositol 3 and 4 kinase 0.0018 0.0026 0.0026
Mycobacterium leprae PROBABLE DNA POLYMERASE III (ALPHA CHAIN) DNAE1 (DNA NUCLEOTIDYLTRANSFERASE) 0.0044 0.0188 1
Treponema pallidum asparaginyl-tRNA synthetase 0.0044 0.0188 0.1455
Schistosoma mansoni importin beta-1 0.003 0.01 0.0184
Leishmania major replication Factor A 28 kDa subunit, putative 0.0044 0.0188 0.0639
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0185 0.1055 0.194
Trypanosoma brucei protein phosphatase 1 0.0019 0.003 0.0017
Schistosoma mansoni aspartyl-tRNA synthetase 0.0044 0.0188 0.0346
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0022 0.0051 0.0362
Trypanosoma cruzi serine/threonine protein phosphatase catalytic subunit, putative 0.003 0.01 0.0292
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0031 0.0056
Echinococcus granulosus mixed lineage leukemia protein mll 0.0014 0.0003 0.0005
Trichomonas vaginalis penicillin-binding protein, putative 0.0039 0.0156 0.024
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0031 0.0031

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.2818 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 16.5113 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) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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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