Detailed information for compound 1841271

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 366.197 | Formula: C15H15IN2O
  • H donors: 2 H acceptors: 1 LogP: 3.47 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N[C@H](c1ccccc1)C)Nc1cccc(c1)I
  • InChi: 1S/C15H15IN2O/c1-11(12-6-3-2-4-7-12)17-15(19)18-14-9-5-8-13(16)10-14/h2-11H,1H3,(H2,17,18,19)/t11-/m0/s1
  • InChiKey: NYLFUIJBUYBDPK-NSHDSACASA-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
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0047 0.0058 0.0853
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0005 0.0005
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0122 0.0197 0.0195
Toxoplasma gondii exonuclease III APE 0.0022 0.0012 0.0384
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0033 0.138
Echinococcus multilocularis microtubule associated protein 2 0.1598 0.2929 0.2929
Brugia malayi Pyruvate kinase, muscle isozyme 0.0039 0.0043 0.0043
Onchocerca volvulus 0.0096 0.015 0.3104
Echinococcus granulosus pyruvate kinase 0.0039 0.0043 0.0043
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0026 0.002 0.0348
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.0072 0.1281
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0033 0.138
Echinococcus granulosus lysine specific demethylase 6a 0.0029 0.0025 0.0025
Echinococcus multilocularis geminin 0.0196 0.0335 0.0335
Echinococcus granulosus pyruvate kinase 0.002 0.0008 0.0008
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0022 0.0012 0.0561
Loa Loa (eye worm) hypothetical protein 0.0018 0.0005 0.0005
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0042 0.0049 0.0049
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0026 0.002 0.0348
Schistosoma mansoni kinase 0.0056 0.0074 0.0072
Schistosoma mansoni cpg binding protein 0.0057 0.0077 0.0075
Loa Loa (eye worm) hypothetical protein 0.0076 0.0112 0.0112
Onchocerca volvulus Alhambra homolog 0.0034 0.0034 0.0699
Loa Loa (eye worm) glutaminase 2 0.0317 0.0557 0.0557
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0034 0.0612
Schistosoma mansoni ap endonuclease 0.0022 0.0012 0.001
Entamoeba histolytica acyl-coA synthetase, putative 0.0047 0.0058 0.284
Echinococcus granulosus neutral alpha glucosidase AB 0.0042 0.0049 0.0049
Schistosoma mansoni 6-phosphofructokinase 0.0126 0.0204 0.0203
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0022 0.0012 0.0012
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0063 0.0088 0.0088
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0126 0.0204 1
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0174 0.3116
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0026 0.002 0.0348
Echinococcus granulosus pyruvate kinase 0.002 0.0008 0.0008
Echinococcus granulosus polycomb protein SCMH1 0.0055 0.0074 0.0074
Leishmania major phosphopantetheinyl transferase-like protein 0.0027 0.0022 0.1042
Toxoplasma gondii 4'-phosphopantetheinyl transferase domain-containing protein 0.0027 0.0022 0.0969
Echinococcus granulosus PHD finger protein rhinoceros 0.0034 0.0034 0.0034
Brugia malayi jmjC domain containing protein 0.0029 0.0025 0.0025
Entamoeba histolytica pyruvate kinase, putative 0.0027 0.0021 0.1029
Plasmodium falciparum acyl-CoA synthetase 0.0035 0.0036 0.8241
Schistosoma mansoni cpg binding protein 0.006 0.0083 0.0081
Schistosoma mansoni pyruvate kinase 0.002 0.0008 0.0006
Echinococcus granulosus SAM and MBT domain containing protein 0.0055 0.0074 0.0074
Loa Loa (eye worm) hypothetical protein 0.0055 0.0074 0.0073
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0029 0.0025 0.1188
Schistosoma mansoni intermediate filament proteins 0.0026 0.002 0.0018
Echinococcus granulosus geminin 0.0196 0.0335 0.0335
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0034 0.0612
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0047 0.0058 0.0853
Onchocerca volvulus Serine\/threonine kinase homolog 0.0109 0.0174 0.3608
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0096 0.0149 0.0149
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0026 0.002 0.0018
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0033 0.138
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0022 0.0012 0.0561
Brugia malayi Calcitonin receptor-like protein seb-1 0.0058 0.0078 0.0078
Onchocerca volvulus Huntingtin homolog 0.0118 0.0191 0.3954
Loa Loa (eye worm) apoptosis regulator protein 0.0096 0.0149 0.0149
Echinococcus multilocularis survival motor neuron protein 1 0.0228 0.0394 0.0394
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0179 0.0302 0.0302
Leishmania major ATP-dependent phosphofructokinase 0.0126 0.0204 1
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0109 0.0174 0.0174
Loa Loa (eye worm) PHD-finger family protein 0.0034 0.0034 0.0034
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0096 0.0149 0.0149
Trypanosoma brucei glucosidase, putative 0.0042 0.0049 0.2382
Schistosoma mansoni protein phosphatase 2C 0.0029 0.0025 0.0023
Entamoeba histolytica phosphofructokinase, putative 0.0126 0.0204 1
Trichomonas vaginalis phosphofructokinase, putative 0.0126 0.0204 0.3664
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0018 0.0005 0.0005
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0043 0.0043
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0032 0.0031 0.0031
Mycobacterium ulcerans glutaminase 0.0317 0.0557 1
Schistosoma mansoni tar DNA-binding protein 0.0147 0.0243 0.0241
Echinococcus multilocularis lysosomal alpha glucosidase 0.0189 0.0321 0.0321
Leishmania major pyruvate kinase 0.0039 0.0043 0.2089
Onchocerca volvulus 0.0026 0.002 0.0403
Echinococcus multilocularis L aminoadipate semialdehyde 0.0096 0.015 0.015
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0043 0.0886
Loa Loa (eye worm) hypothetical protein 0.0118 0.0191 0.019
Schistosoma mansoni myelin transcription factor 1 myt1 0.0063 0.0088 0.0086
Loa Loa (eye worm) mbt repeat family protein 0.0055 0.0074 0.0073
Schistosoma mansoni ap endonuclease 0.0022 0.0012 0.001
Brugia malayi aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase 0.0096 0.015 0.0149
Brugia malayi Latrophilin receptor protein 2 0.0018 0.0005 0.0005
Plasmodium vivax 6-phosphofructokinase, putative 0.0034 0.0034 0.7726
Trichomonas vaginalis pyruvate kinase, putative 0.0039 0.0043 0.0765
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0034 0.0034 0.5997
Schistosoma mansoni tar DNA-binding protein 0.0147 0.0243 0.0241
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0096 0.0149 0.0147
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0047 0.0058 0.266
Leishmania major hypothetical protein, conserved 0.0029 0.0025 0.1221
Toxoplasma gondii PHD-finger domain-containing protein 0.0034 0.0034 0.1706
Toxoplasma gondii 4'-phosphopantetheinyl transferase superfamily protein 0.0027 0.0022 0.0969
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0026 0.002 0.0348
Loa Loa (eye worm) hypothetical protein 0.0034 0.0034 0.0034
Onchocerca volvulus Huntingtin homolog 0.0118 0.0191 0.3954
Schistosoma mansoni hypothetical protein 0.0018 0.0005 0.0003
Echinococcus multilocularis tar DNA binding protein 0.0147 0.0243 0.0243
Brugia malayi hypothetical protein 0.0118 0.0191 0.019
Loa Loa (eye worm) hypothetical protein 0.0035 0.0036 0.0036
Loa Loa (eye worm) hypothetical protein 0.0035 0.0036 0.0036
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0042 0.0049 0.0873
Trichomonas vaginalis alpha-glucosidase, putative 0.0042 0.0049 0.0873
Echinococcus granulosus JmjC domain containing protein 4 0.0029 0.0025 0.0025
Leishmania major alpha glucosidase II subunit, putative 0.0042 0.0049 0.2382
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0035 0.0036 0.045
Loa Loa (eye worm) hypothetical protein 0.0047 0.0058 0.0058
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0058 0.0078 0.0078
Echinococcus multilocularis peregrin 0.0034 0.0034 0.0034
Trichomonas vaginalis chromobox protein, putative 0.0049 0.0062 0.1099
Echinococcus multilocularis lysine specific demethylase 5A 0.0109 0.0173 0.0173
Echinococcus granulosus pyruvate kinase 0.0039 0.0043 0.0043
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0047 0.0058 0.0853
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0022 0.0012 0.1713
Mycobacterium ulcerans pyruvate kinase 0.0039 0.0043 0.0572
Brugia malayi Bromodomain containing protein 0.0034 0.0034 0.0034
Brugia malayi CXXC zinc finger family protein 0.0057 0.0077 0.0076
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0058 0.0058
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0018 0.0005 0.0245
Plasmodium vivax pyruvate kinase 2, putative 0.002 0.0008 0.0753
Echinococcus multilocularis pyruvate kinase 0.003 0.0028 0.0028
Trichomonas vaginalis pyruvate kinase, putative 0.0039 0.0043 0.0765
Schistosoma mansoni sex comb on midleg homolog 0.0055 0.0074 0.0072
Loa Loa (eye worm) hypothetical protein 0.0118 0.0191 0.019
Trichomonas vaginalis ap endonuclease, putative 0.0022 0.0012 0.0206
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.0005 0.0005
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0026 0.002 0.0348
Toxoplasma gondii 6-phosphofructokinase 0.0034 0.0034 0.1733
Trypanosoma cruzi pyruvate kinase 2, putative 0.0039 0.0043 0.2089
Schistosoma mansoni aminoadipate-semialdehyde dehydrogenase 0.0096 0.015 0.0148
Schistosoma mansoni apoptosis regulator bax 0.0096 0.0149 0.0147
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0034 0.0034 0.1583
Loa Loa (eye worm) intermediate filament protein 0.0026 0.002 0.0019
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0047 0.0058 0.2007
Schistosoma mansoni pyruvate kinase 0.0039 0.0043 0.0041
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0058 0.0078 0.0078
Loa Loa (eye worm) glutaminase 0.0317 0.0557 0.0557
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0126 0.0204 1
Loa Loa (eye worm) histone methyltransferase 0.0019 0.0006 0.0006
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0126 0.0204 1
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0063 0.0088 0.0088
Echinococcus granulosus chromobox protein 1 0.0081 0.0121 0.0121
Echinococcus multilocularis pyruvate kinase 0.002 0.0008 0.0008
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0026 0.002 0.0348
Entamoeba histolytica phosphofructokinase, putative 0.0126 0.0204 1
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0043 0.0043
Giardia lamblia Pyruvate kinase 0.0039 0.0043 0.2099
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0222 0.0382 0.0382
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0038 0.1932
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0222 0.0382 0.0382
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0036 0.0038 0.0038
Echinococcus granulosus GPCR family 2 0.0018 0.0005 0.0005
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0026 0.002 0.0348
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0018 0.0005 0.0005
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0022 0.0012 0.0011
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0147 0.0243 0.0243
Echinococcus multilocularis pyruvate kinase 0.0039 0.0043 0.0043
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0034 0.0034 0.167
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0018 0.0005 0.0003
Schistosoma mansoni hypothetical protein 0.0196 0.0335 0.0333
Echinococcus granulosus histone acetyltransferase MYST2 0.0063 0.0088 0.0088
Echinococcus multilocularis cpg binding protein 0.006 0.0083 0.0083
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0039 0.0043 0.189
Loa Loa (eye worm) RNA binding protein 0.0147 0.0243 0.0243
Echinococcus granulosus phd:f box containing protein 0.0029 0.0025 0.0025
Loa Loa (eye worm) TAR-binding protein 0.0147 0.0243 0.0243
Loa Loa (eye worm) hypothetical protein 0.0063 0.0088 0.0088
Loa Loa (eye worm) isocitrate dehydrogenase 0.0018 0.0005 0.0005
Echinococcus granulosus lamin dm0 0.0026 0.002 0.002
Schistosoma mansoni jumonji/arid domain-containing protein 0.0112 0.0179 0.0177
Entamoeba histolytica acyl-CoA synthetase, putative 0.0047 0.0058 0.284
Loa Loa (eye worm) CXXC zinc finger family protein 0.0057 0.0077 0.0076
Loa Loa (eye worm) hypothetical protein 0.0029 0.0025 0.0025
Echinococcus multilocularis pyruvate kinase 0.002 0.0008 0.0008
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0058 0.0058
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0058 0.0853
Plasmodium falciparum JmjC domain-containing protein, putative 0.0029 0.0025 0.5293
Schistosoma mansoni hypothetical protein 0.0034 0.0034 0.0032
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0126 0.0204 1
Trypanosoma brucei pyruvate kinase 1 0.0039 0.0043 0.2089
Trichomonas vaginalis alpha-glucosidase, putative 0.0042 0.0049 0.0873
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0063 0.0088 0.0088
Brugia malayi latrophilin 2 splice variant baaae 0.0039 0.0045 0.0044
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0034 0.0612
Schistosoma mansoni microtubule-associated protein tau 0.1598 0.2929 0.2927
Loa Loa (eye worm) jmjC domain-containing protein 0.0029 0.0025 0.0025
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0029 0.0025 0.1188
Trichomonas vaginalis alpha-glucosidase, putative 0.0042 0.0049 0.0873
Echinococcus multilocularis alpha 1,6 mannosyl glycoprotein 0.5419 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0049 0.2382
Plasmodium falciparum pyruvate kinase 2 0.002 0.0008 0.0753
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0022 0.0012 0.0218
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0018 0.0005 0.0245
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0026 0.002 0.0348
Trichomonas vaginalis conserved hypothetical protein 0.002 0.0009 0.015
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0096 0.0149 0.0149
Schistosoma mansoni hypothetical protein 0.0809 0.1469 0.1467
Echinococcus multilocularis chromobox protein 1 0.0081 0.0121 0.0121
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0033 0.0033 0.138
Schistosoma mansoni phosphatidylserine receptor 0.0029 0.0025 0.0023
Echinococcus multilocularis 6 phosphofructokinase 0.0126 0.0204 0.0204
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0019 0.0007 0.0119
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0034 0.0612
Echinococcus granulosus L aminoadipate semialdehyde 0.0096 0.015 0.015
Echinococcus multilocularis phd:f box containing protein 0.0029 0.0025 0.0025
Echinococcus granulosus cpg binding protein 0.006 0.0083 0.0083
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0038 0.0036
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0022 0.0012 0.0324
Brugia malayi exodeoxyribonuclease III family protein 0.0022 0.0012 0.0011
Echinococcus granulosus lysosomal alpha glucosidase 0.0189 0.0321 0.0321
Loa Loa (eye worm) hypothetical protein 0.0026 0.002 0.0019
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0019 0.0006 0.0006
Loa Loa (eye worm) 6-phosphofructokinase 0.0126 0.0204 0.0204
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0109 0.0174 0.8505
Echinococcus granulosus histone lysine methyltransferase setb 0.0036 0.0038 0.0038
Brugia malayi hypothetical protein 0.0228 0.0394 0.0394
Entamoeba histolytica serine/threonine protein kinase, putative 0.0109 0.0174 0.8505
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0058 0.284
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0005 0.0005
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0058 0.284
Trichomonas vaginalis chromobox protein, putative 0.0081 0.0121 0.2163
Brugia malayi mbt repeat family protein 0.0055 0.0074 0.0073
Loa Loa (eye worm) hypothetical protein 0.0228 0.0394 0.0394
Loa Loa (eye worm) pyruvate kinase 0.0039 0.0043 0.0043
Mycobacterium ulcerans phosphopantetheinyl transferase, PptII 0.0027 0.0022 0.018
Brugia malayi jmjC domain containing protein 0.0029 0.0025 0.0025
Loa Loa (eye worm) 6-phosphofructokinase 0.0126 0.0204 0.0204
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0174 0.3116
Onchocerca volvulus 0.0276 0.0481 1
Onchocerca volvulus 0.0035 0.0037 0.0764
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0179 0.0302 0.0302
Plasmodium vivax JmjC domain containing protein 0.0029 0.0025 0.5293
Echinococcus granulosus pyruvate kinase 0.002 0.0008 0.0008
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0034 0.0034 0.1733
Echinococcus granulosus peregrin 0.0034 0.0034 0.0034
Loa Loa (eye worm) hypothetical protein 0.0058 0.0078 0.0078
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0049 0.0062 0.1272
Brugia malayi jmjC domain containing protein 0.0029 0.0025 0.0025
Trypanosoma cruzi pyruvate kinase 2, putative 0.0039 0.0043 0.2089
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0032 0.0031 0.0031
Brugia malayi F/Y-rich N-terminus family protein 0.003 0.0026 0.0026
Giardia lamblia PHD finger protein 15 0.0034 0.0034 0.1556
Treponema pallidum 4'-phosphopantetheinyl transferase 0.0027 0.0022 0.0509
Echinococcus multilocularis musashi 0.0026 0.002 0.002
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0042 0.0049 0.26
Loa Loa (eye worm) hypothetical protein 0.0036 0.0038 0.0037
Brugia malayi jmjC domain containing protein 0.0112 0.0179 0.0179
Schistosoma mansoni jumonji domain containing protein 0.0029 0.0025 0.0023
Loa Loa (eye worm) hypothetical protein 0.0045 0.0055 0.0055
Onchocerca volvulus 0.0047 0.0058 0.1193
Toxoplasma gondii PHD-finger domain-containing protein 0.0034 0.0034 0.1706
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0005 0.0005
Echinococcus multilocularis GPCR, family 2 0.0018 0.0005 0.0005
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0174 0.3116
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0022 0.0012 0.0012
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0038 0.0036
Echinococcus multilocularis pyruvate kinase 0.0039 0.0043 0.0043
Brugia malayi 6-phosphofructokinase 0.0126 0.0204 0.0204
Loa Loa (eye worm) hypothetical protein 0.0027 0.0021 0.0021
Echinococcus multilocularis jumonji domain containing 1A 0.0029 0.0025 0.0025
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0038 0.0038
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0189 0.0321 0.032
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0031 0.0546
Echinococcus granulosus alpha 16 mannosyl glycoprotein 0.5419 1 1
Mycobacterium ulcerans hypothetical protein 0.0047 0.0058 0.0853
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0042 0.0049 0.0873
Mycobacterium tuberculosis holo-[acyl-carrier protein] synthase AcpS (holo-ACP synthase) (CoA:APO-[ACP]pantetheinephosphotransferase) (CoA:APO-[acyl-carrie 0.0027 0.0022 0.0816
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0034 0.0034 0.5997
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0043 0.0886
Schistosoma mansoni tar DNA-binding protein 0.0147 0.0243 0.0241
Wolbachia endosymbiont of Brugia malayi 4'-phosphopantetheinyl transferase 0.0027 0.0022 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0189 0.0321 0.0321
Brugia malayi Pre-SET motif family protein 0.0036 0.0038 0.0037
Brugia malayi Glycosyl hydrolases family 31 protein 0.0189 0.0321 0.032
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0022 0.0012 0.0561
Schistosoma mansoni hypothetical protein 0.034 0.0601 0.0599
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0034 0.0034 0.7726
Brugia malayi RNA recognition motif domain containing protein 0.0147 0.0243 0.0243
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0022 0.0012 0.0561
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0034 0.0034 0.7726
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.0055 0.0985
Brugia malayi 6-phosphofructokinase 0.0126 0.0204 0.0204
Loa Loa (eye worm) hypothetical protein 0.0096 0.015 0.0149
Loa Loa (eye worm) jmjC domain-containing protein 0.0112 0.0179 0.0179
Echinococcus multilocularis histone acetyltransferase MYST2 0.0063 0.0088 0.0088
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0109 0.0174 0.0174
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0174 0.3116
Schistosoma mansoni hypothetical protein 0.0018 0.0005 0.0003
Schistosoma mansoni 6-phosphofructokinase 0.0126 0.0204 0.0203
Loa Loa (eye worm) hypothetical protein 0.0026 0.0019 0.0018
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0034 0.0034 0.0612
Echinococcus multilocularis lamin 0.0026 0.002 0.002
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0005 0.0245
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0018 0.0005 0.0005
Onchocerca volvulus 0.0047 0.0058 0.1205
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0174 0.3116
Loa Loa (eye worm) hypothetical protein 0.0029 0.0025 0.0025
Schistosoma mansoni hypothetical protein 0.0018 0.0005 0.0003
Plasmodium falciparum holo-[acyl-carrier-protein] synthase, putative 0.0027 0.0022 0.4319
Loa Loa (eye worm) pyruvate kinase-PB 0.0027 0.0021 0.0021
Schistosoma mansoni tar DNA-binding protein 0.0147 0.0243 0.0241
Loa Loa (eye worm) jmjC domain-containing protein 0.0029 0.0025 0.0025
Schistosoma mansoni beta-12-n-acetylglucosaminyltransferase II 0.5419 1 1
Trichomonas vaginalis phosphofructokinase, putative 0.0126 0.0204 0.3664
Trichomonas vaginalis ap endonuclease, putative 0.0022 0.0012 0.0206
Loa Loa (eye worm) CHromoDomain protein family member 0.0016 0.0002 0.0002
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0047 0.0058 0.2007
Loa Loa (eye worm) hypothetical protein 0.0047 0.0058 0.0058
Trichomonas vaginalis phosphofructokinase, putative 0.0126 0.0204 0.3664
Brugia malayi Pyruvate kinase, M2 isozyme 0.0039 0.0043 0.0043
Schistosoma mansoni hypothetical protein 0.0039 0.0045 0.0043
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0035 0.0036 0.1558
Loa Loa (eye worm) hypothetical protein 0.0035 0.0036 0.0036
Schistosoma mansoni sex comb on midleg homolog 0.0055 0.0074 0.0072
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0029 0.0025 0.1221
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0042 0.0049 0.2382
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0049 0.0062 0.006
Trichomonas vaginalis glutaminase, putative 0.0317 0.0557 1
Trypanosoma cruzi hypothetical protein, conserved 0.0042 0.0049 0.2382
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0022 0.0012 0.0561
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0035 0.0036 0.6903
Schistosoma mansoni lamin 0.0026 0.002 0.0018
Trichomonas vaginalis alpha-glucosidase, putative 0.0042 0.0049 0.0873
Giardia lamblia Kinase, PLK 0.0109 0.0174 1
Echinococcus granulosus lamin 0.0026 0.002 0.002
Echinococcus granulosus microtubule associated protein 2 0.1598 0.2929 0.2929
Schistosoma mansoni phd/f-box containing protein 0.0029 0.0025 0.0023
Plasmodium vivax hypothetical protein, conserved 0.0034 0.0034 0.7606
Toxoplasma gondii histone lysine methyltransferase SET1 0.0109 0.0173 1
Schistosoma mansoni pyruvate kinase 0.0039 0.0043 0.0041
Echinococcus granulosus tar DNA binding protein 0.0147 0.0243 0.0243
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0019 0.0006 0.0006
Brugia malayi glutaminase DH11.1 0.0317 0.0557 0.0557
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0034 0.0612
Schistosoma mansoni chromobox protein 0.0081 0.0121 0.0119
Loa Loa (eye worm) hypothetical protein 0.0039 0.0045 0.0044
Echinococcus multilocularis lysine specific demethylase 6a 0.0029 0.0025 0.0025
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0058 0.0853
Brugia malayi TAR-binding protein 0.0147 0.0243 0.0243
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.0005 0.0005
Echinococcus granulosus 6 phosphofructokinase 0.0126 0.0204 0.0204
Schistosoma mansoni hypothetical protein 0.0096 0.0149 0.0147
Trypanosoma cruzi polo-like protein kinase, putative 0.0109 0.0174 0.8505
Trichomonas vaginalis set domain proteins, putative 0.0276 0.0481 0.8637
Trichomonas vaginalis conserved hypothetical protein 0.0032 0.0031 0.0546
Echinococcus multilocularis JmjC domain containing protein 4 0.0029 0.0025 0.0025
Plasmodium vivax 6-phosphofructokinase, putative 0.0034 0.0034 0.7726
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0055 0.0074 0.0072
Loa Loa (eye worm) hypothetical protein 0.0035 0.0036 0.0036
Mycobacterium ulcerans 6-phosphofructokinase 0.0126 0.0204 0.3531
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0022 0.0012 0.1713
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0109 0.0174 0.0174
Schistosoma mansoni chromobox protein 0.0081 0.0121 0.0119
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0096 0.0149 0.0149
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0096 0.0149 0.0149
Trichomonas vaginalis CAMK family protein kinase 0.0054 0.0072 0.1281
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.002 0.0019
Brugia malayi CHD4 protein 0.0016 0.0002 0.0002
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0042 0.0049 0.2382
Schistosoma mansoni hypothetical protein 0.0018 0.0005 0.0003
Brugia malayi Isocitrate dehydrogenase 0.0018 0.0005 0.0005
Onchocerca volvulus 0.0055 0.0074 0.1525
Schistosoma mansoni alpha glucosidase 0.0042 0.0049 0.0047
Brugia malayi jmjC domain containing protein 0.0029 0.0025 0.0025
Echinococcus multilocularis SAM and MBT domain containing protein 0.0055 0.0074 0.0074
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.0005 0.0005
Leishmania major 4-coumarate:coa ligase-like protein 0.0047 0.0058 0.284
Trichomonas vaginalis sucrase-isomaltase, putative 0.0042 0.0049 0.0873
Plasmodium falciparum phd finger protein, putative 0.0034 0.0034 0.7606
Plasmodium vivax pyruvate kinase, putative 0.0039 0.0043 1
Echinococcus multilocularis PHD finger protein rhinoceros 0.0034 0.0034 0.0034
Schistosoma mansoni serine/threonine protein kinase 0.0109 0.0174 0.0172
Schistosoma mansoni cpg binding protein 0.006 0.0083 0.0081
Echinococcus multilocularis isocitrate dehydrogenase 0.0018 0.0005 0.0005
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0126 0.0204 1
Brugia malayi mbt repeat family protein 0.0055 0.0074 0.0073
Brugia malayi Pre-SET motif family protein 0.0242 0.042 0.0419
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0029 0.0025 0.1221
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.002 0.0009 0.015
Plasmodium falciparum pyruvate kinase 0.0039 0.0043 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0058 0.0057
Echinococcus multilocularis jumonji domain containing protein 0.0047 0.0058 0.0058
Trichomonas vaginalis phosphofructokinase, putative 0.0126 0.0204 0.3664
Schistosoma mansoni alpha-glucosidase 0.0162 0.0272 0.027
Loa Loa (eye worm) jmjC domain-containing protein 0.007 0.0101 0.01
Brugia malayi isocitrate dehydrogenase 0.0018 0.0005 0.0005
Leishmania major pyruvate kinase 0.0039 0.0043 0.2089
Loa Loa (eye worm) phosphofructokinase 0.0126 0.0204 0.0204
Trypanosoma brucei hypothetical protein, conserved 0.0027 0.0022 0.1042
Brugia malayi phosphofructokinase 0.0126 0.0204 0.0204
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.002 0.0019
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0055 0.0074 0.1525
Toxoplasma gondii pyruvate kinase PyKII 0.002 0.0008 0.0169
Echinococcus granulosus jumonji domain containing protein 0.0047 0.0058 0.0058
Echinococcus multilocularis polycomb protein SCMH1 0.0055 0.0074 0.0074
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.0005 0.0005
Onchocerca volvulus 0.0109 0.0173 0.3598
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0174 0.3116
Echinococcus multilocularis dnaJ subfamily B 0.0809 0.1469 0.1469
Schistosoma mansoni glutaminase 0.0317 0.0557 0.0555
Echinococcus granulosus lysine specific demethylase 5A 0.0112 0.0179 0.0179
Trypanosoma brucei polo-like protein kinase 0.0109 0.0174 0.8505
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0242 0.042 0.0419
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0005 0.0245
Brugia malayi jmjC domain containing protein 0.0179 0.0302 0.0302
Echinococcus multilocularis chromobox protein 1 0.0081 0.0121 0.0121
Mycobacterium ulcerans 4'-phosphopantetheinyl transferase 0.0027 0.0022 0.018
Echinococcus granulosus jumonji domain containing 1A 0.0029 0.0025 0.0025
Loa Loa (eye worm) jmjC domain-containing protein 0.0029 0.0025 0.0025
Schistosoma mansoni lamin 0.0026 0.002 0.0018
Trichomonas vaginalis phosphofructokinase, putative 0.0034 0.0034 0.0612
Onchocerca volvulus 0.0049 0.0062 0.1286
Loa Loa (eye worm) hypothetical protein 0.0096 0.0149 0.0149
Schistosoma mansoni hypothetical protein 0.0047 0.0058 0.0056
Schistosoma mansoni alpha-glucosidase 0.0162 0.0272 0.027
Schistosoma mansoni survival motor neuron protein 0.0047 0.0058 0.0056
Loa Loa (eye worm) hypothetical protein 0.0035 0.0037 0.0037
Echinococcus multilocularis neutral alpha glucosidase AB 0.0042 0.0049 0.0049
Trichomonas vaginalis chromobox protein, putative 0.0049 0.0062 0.1099
Loa Loa (eye worm) hypothetical protein 0.0035 0.0036 0.0036
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0034 0.0034 0.0032
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0029 0.0025 0.1221
Brugia malayi RNA binding protein 0.0147 0.0243 0.0243
Onchocerca volvulus 0.0026 0.002 0.0403
Entamoeba histolytica acyl-CoA synthetase, putative 0.0047 0.0058 0.284
Echinococcus multilocularis lamin dm0 0.0026 0.002 0.002
Schistosoma mansoni tar DNA-binding protein 0.0147 0.0243 0.0241
Onchocerca volvulus 0.0057 0.0077 0.1586
Brugia malayi chromobox protein homolog 3 0.0045 0.0055 0.0055
Loa Loa (eye worm) hypothetical protein 0.5419 1 1
Entamoeba histolytica phosphofructokinase, putative 0.0126 0.0204 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0018 0.0005 0.0245
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0047 0.0058 0.266
Brugia malayi AMP-binding enzyme family protein 0.0047 0.0058 0.0058
Schistosoma mansoni hypothetical protein 0.0096 0.0149 0.0147
Brugia malayi intermediate filament protein 0.0026 0.002 0.0019
Echinococcus granulosus intermediate filament protein 0.0026 0.002 0.002
Echinococcus granulosus chromobox protein 1 0.0081 0.0121 0.0121
Trichomonas vaginalis maltase-glucoamylase, putative 0.0042 0.0049 0.0873
Entamoeba histolytica hypothetical protein 0.0027 0.0022 0.1042
Loa Loa (eye worm) MBCTL1 0.0063 0.0088 0.0088
Brugia malayi Heterochromatin protein 1 0.0081 0.0121 0.012
Plasmodium vivax holo-[acyl-carrier-protein] synthase, putative 0.0027 0.0022 0.4319
Trichomonas vaginalis alpha-glucosidase, putative 0.0042 0.0049 0.0873
Chlamydia trachomatis pyruvate kinase 0.0039 0.0043 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0047 0.0058 0.0853
Brugia malayi PHD-finger family protein 0.0034 0.0034 0.0034
Brugia malayi serine/threonine-protein kinase plk-2 0.0109 0.0174 0.0174
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0038 0.0036
Trypanosoma brucei pyruvate kinase 1, putative 0.0039 0.0043 0.2089
Trichomonas vaginalis CAMK family protein kinase 0.0109 0.0174 0.3116
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0016 0.0002 0.0002
Trichomonas vaginalis chromobox protein, putative 0.0081 0.0121 0.2163
Echinococcus granulosus survival motor neuron protein 1 0.0228 0.0394 0.0394
Loa Loa (eye worm) hypothetical protein 0.0039 0.0043 0.0043
Toxoplasma gondii pyruvate kinase PyK1 0.0039 0.0043 0.2243
Loa Loa (eye worm) hypothetical protein 0.0047 0.0058 0.0058
Brugia malayi Glycosyl hydrolases family 31 protein 0.0042 0.0049 0.0049
Toxoplasma gondii phosphofructokinase PFKII 0.0034 0.0034 0.1733
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0047 0.0058 0.0853
Trypanosoma cruzi polo-like protein kinase, putative 0.0109 0.0174 0.8505
Plasmodium vivax SET domain protein, putative 0.0036 0.0038 0.8613
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0018 0.0005 0.0005
Schistosoma mansoni hypothetical protein 0.0096 0.0149 0.0147
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0045 0.0055 0.114
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0016 0.0002 0.0002
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0029 0.0025 0.0023
Loa Loa (eye worm) heterochromatin protein 1 0.0081 0.0121 0.012
Schistosoma mansoni hypothetical protein 0.0196 0.0335 0.0333
Plasmodium vivax acyl-CoA synthetase, putative 0.0035 0.0036 0.8241
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0034 0.0034 0.1175
Echinococcus granulosus dnaJ subfamily B 0.0809 0.1469 0.1469
Schistosoma mansoni jumonji domain containing protein 0.0156 0.026 0.0258
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.0033 0.0033
Trichomonas vaginalis conserved hypothetical protein 0.0045 0.0055 0.0985
Schistosoma mansoni jumonji/arid domain-containing protein 0.0112 0.0179 0.0177
Mycobacterium leprae Probable pyruvate kinase PykA 0.0039 0.0043 0.1169
Echinococcus multilocularis pyruvate kinase 0.002 0.0008 0.0008
Onchocerca volvulus Pyruvate kinase homolog 0.0039 0.0043 0.0886

Activities

Activity type Activity value Assay description Source Reference
Activity (ADMET) = 0 % Phytotoxicity against directly seeded Oryza sativa (rice) seedlings assessed as phytotoxic activity ratings (0- no effect to 5-complete killing rating scale) at 100 g/a measured after 3 weeks post compound treatment under green house conditions ChEMBL. 27393589
Activity (functional) = 83 % Relieving activity against bensulfuron-methyl induced injury to Oryza sativa (rice) assessed as growth rate at 1 uM (Rbv = 46 to 53%) ChEMBL. 27393060

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

Bibliographic References

No literature references available for this target.

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