Detailed information for compound 830994

Basic information

Technical information
  • TDR Targets ID: 830994
  • Name: N-[4-(4-ethoxyphenyl)-1,2,5-oxadiazol-3-yl]-5 -ethyl-3-methyl-1-benzofuran-2-carboxamide
  • MW: 391.42 | Formula: C22H21N3O4
  • H donors: 1 H acceptors: 3 LogP: 4.82 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccc(cc1)c1nonc1NC(=O)c1oc2c(c1C)cc(cc2)CC
  • InChi: 1S/C22H21N3O4/c1-4-14-6-11-18-17(12-14)13(3)20(28-18)22(26)23-21-19(24-29-25-21)15-7-9-16(10-8-15)27-5-2/h6-12H,4-5H2,1-3H3,(H,23,25,26)
  • InChiKey: NTUDBDCQLMFGMO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[4-(4-ethoxyphenyl)-1,2,5-oxadiazol-3-yl]-5-ethyl-3-methyl-benzofuran-2-carboxamide
  • N-[4-(4-ethoxyphenyl)-1,2,5-oxadiazol-3-yl]-5-ethyl-3-methyl-2-benzofurancarboxamide
  • N-[4-(4-ethoxyphenyl)furazan-3-yl]-5-ethyl-3-methyl-benzofuran-2-carboxamide
  • D269-1118
  • NCGC00117772-01

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens euchromatic histone-lysine N-methyltransferase 2 Starlite/ChEMBL No references
Homo sapiens mechanistic target of rapamycin (serine/threonine kinase) Starlite/ChEMBL No references
Escherichia coli penicillin-binding protein Starlite/ChEMBL No references
Homo sapiens bromodomain adjacent to zinc finger domain, 2B Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum ko:K07203 FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Trypanosoma brucei gambiense phosphatidylinositol 3-kinase tor, putative Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Neospora caninum Phosphatidylinositol 3-kinase tor2, related Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus multilocularis bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Toxoplasma gondii target of rapamycin (TOR), putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Echinococcus granulosus bromodomain adjacent to zinc finger domain Get druggable targets OG5_131570 All targets in OG5_131570
Leishmania major target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Leishmania donovani Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum Cleft lip and palate transmembrane protein 1-like protein, putative Get druggable targets OG5_131570 All targets in OG5_131570
Leishmania major target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) phosphatidylinositol 3 Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma brucei gambiense phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum ko:K01549 ATP synthase [EC3.6.3.14], putative Get druggable targets OG5_131570 All targets in OG5_131570
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma congolense Phosphatidylinositol 3-kinase tor1 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis set domain proteins, putative Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania infantum target of rapamycin (TOR) kinase 1, putative Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trypanosoma congolense Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania donovani Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Echinococcus granulosus FKBP12 rapamycin complex associated protein Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania braziliensis target of rapamycin (TOR) kinase 2, putative Get druggable targets OG5_127212 All targets in OG5_127212
Leishmania mexicana phosphatidylinositol 3-kinase (tor2)-like protein Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upsteam TOR2 CDS (CaP19.9461) Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Mycobacterium tuberculosis Possible penicillin-binding protein Get druggable targets OG5_149948 All targets in OG5_149948
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans frameshifted from upstream TOR2 CDS (CaP19.1905) Get druggable targets OG5_127212 All targets in OG5_127212
Brugia malayi Pre-SET motif family protein Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Giardia lamblia GTOR Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) pre-SET domain-containing protein family protein Get druggable targets OG5_131470 All targets in OG5_131470
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to internal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) protein/phosphatidylinositol kinases involved in n Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum FKBP12-rapamycin complex-associated protein, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related Get druggable targets OG5_127212 All targets in OG5_127212
Candida albicans similar to N terminal region of S. cerevisiae TOR2 (YKL203C) and TOR1 (YJR066W) putative protein/phosphatidylinositol kinases in Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum expressed protein Get druggable targets OG5_131570 All targets in OG5_131570
Brugia malayi Bromodomain containing protein Get druggable targets OG5_131570 All targets in OG5_131570
Onchocerca volvulus Get druggable targets OG5_131470 All targets in OG5_131470
Leishmania mexicana phosphatidylinositol 3 kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Schistosoma japonicum Conserved hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
Trypanosoma brucei phosphatidylinositol 4-kinase, putative Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Trichomonas vaginalis PIKK family atypical protein kinase Get druggable targets OG5_127212 All targets in OG5_127212
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_131570 All targets in OG5_131570
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0175 0.0123
Loa Loa (eye worm) hypothetical protein 0.0152 0.1679 0.2165
Mycobacterium ulcerans hypothetical protein 0.0043 0.0314 0.0878
Loa Loa (eye worm) hypothetical protein 0.006 0.0525 0.067
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0314 0.0554
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0175 0.0123
Schistosoma mansoni zinc finger protein 0.0024 0.0065 0.0283
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0054 0.045 1
Loa Loa (eye worm) hypothetical protein 0.0149 0.1635 0.2108
Trypanosoma brucei cytochrome P450, putative 0.002 0.0023 0.051
Brugia malayi POT family protein 0.0308 0.3637 0.47
Brugia malayi PHD-finger family protein 0.0031 0.0152 0.0187
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0027 0.011 0.0479
Brugia malayi Bromodomain containing protein 0.0046 0.0349 0.0443
Schistosoma mansoni hypothetical protein 0.0052 0.0427 0.1862
Loa Loa (eye worm) animal heme peroxidase 0.0063 0.0566 0.0723
Loa Loa (eye worm) blistered cuticle protein 3 0.0063 0.0566 0.0723
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Loa Loa (eye worm) animal heme peroxidase 0.0063 0.0566 0.0723
Mycobacterium ulcerans zinc metalloprotease 0.0201 0.2295 0.6842
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0035 0.0204 0.0861
Loa Loa (eye worm) hypothetical protein 0.0043 0.0314 0.0398
Schistosoma mansoni hypothetical protein 0.0019 0.0007 0.0031
Mycobacterium ulcerans beta-lactamase 0.0043 0.0314 0.0878
Brugia malayi jmjC domain containing protein 0.01 0.1025 0.1318
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.0101 0.1043 0.4544
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0314 0.137
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0036 0.0221 0.0963
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.01 0.1025 0.1019
Mycobacterium leprae probable zinc metalloprotease 0.0201 0.2295 1
Trypanosoma cruzi target of rapamycin kinase 3 0.0043 0.0311 0.691
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0566 0.0723
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0021 0.0027 0.0019
Brugia malayi Blistered cuticle protein 3 0.0063 0.0566 0.0723
Loa Loa (eye worm) cytochrome P450 family protein 0.002 0.0023 0.002
Loa Loa (eye worm) hypothetical protein 0.0152 0.1679 0.2165
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.0002
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0314 0.6985
Echinococcus granulosus fetal alzheimer antigen falz 0.0027 0.011 0.0449
Loa Loa (eye worm) cytochrome P450 family protein 0.0031 0.0159 0.0196
Loa Loa (eye worm) bromodomain containing protein 0.0021 0.0036 0.0037
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0275 0.0432
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0275 0.0432
Trypanosoma cruzi cytochrome P450, putative 0.002 0.0023 0.051
Schistosoma mansoni hypothetical protein 0.0052 0.0427 0.1862
Echinococcus multilocularis FKBP12 rapamycin complex associated protein 0.0054 0.045 0.0443
Brugia malayi beta-lactamase 0.0043 0.0314 0.0398
Leishmania major hypothetical protein, conserved 0.0035 0.0212 0.4709
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.0633 0.7732 1
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.0023 0.0051 0.1136
Trichomonas vaginalis set domain proteins, putative 0.0286 0.3364 1
Brugia malayi hypothetical protein 0.0543 0.6595 0.8528
Schistosoma mansoni hypothetical protein 0.0019 0.0007 0.0031
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Plasmodium vivax SET domain protein, putative 0.0036 0.0221 0.4257
Schistosoma mansoni endothelin-converting enzyme-related 0.0049 0.0383 0.167
Loa Loa (eye worm) hypothetical protein 0.0057 0.048 0.0612
Schistosoma mansoni hypothetical protein 0.0025 0.0081 0.0353
Mycobacterium ulcerans hydrolase/amidase 0.0284 0.3344 1
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0027 0.011 0.0103
Toxoplasma gondii peptidase family M13 protein 0.0201 0.2295 1
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0314 0.6985
Loa Loa (eye worm) hypothetical protein 0.0149 0.1635 0.2108
Loa Loa (eye worm) POT family protein 0.0308 0.3637 0.47
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.01 0.1025 0.445
Loa Loa (eye worm) jmjC domain-containing protein 0.0063 0.0561 0.0716
Echinococcus granulosus PHD finger protein rhinoceros 0.0031 0.0152 0.0632
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0043 0.0311 0.691
Loa Loa (eye worm) peptidase family M13 containing protein 0.0149 0.1635 0.2108
Mycobacterium tuberculosis Probable zinc metalloprotease Zmp1 0.0201 0.2295 0.6724
Loa Loa (eye worm) peptidase family M13 containing protein 0.0149 0.1635 0.2108
Loa Loa (eye worm) hypothetical protein 0.0543 0.6595 0.8528
Loa Loa (eye worm) hypothetical protein 0.01 0.102 0.1311
Toxoplasma gondii ABC1 family protein 0.0043 0.0314 0.0759
Echinococcus multilocularis lysine specific demethylase 5A 0.0037 0.0232 0.0225
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0314 0.0554
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.0002
Loa Loa (eye worm) cytochrome P450 family protein 0.002 0.0023 0.002
Onchocerca volvulus Chorion peroxidase homolog 0.0063 0.0566 0.129
Loa Loa (eye worm) hypothetical protein 0.0043 0.0314 0.0398
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0036 0.0221 0.0323
Schistosoma mansoni hypothetical protein 0.0052 0.0427 0.1862
Brugia malayi hypothetical protein 0.0063 0.0566 0.0723
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0026 0.009 0.2009
Onchocerca volvulus Dual oxidase homolog 0.0063 0.0566 0.129
Loa Loa (eye worm) PHD-finger family protein 0.0031 0.0152 0.0187
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0525 0.067
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0275 0.0432
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0054 0.045 0.1935
Schistosoma mansoni neprilysin 0.0052 0.0427 0.1862
Loa Loa (eye worm) hypothetical protein 0.0043 0.0314 0.0398
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0314 0.0398
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0036 0.0221 0.0214
Schistosoma mansoni peroxidasin 0.0063 0.0566 0.2466
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0566 0.0723
Onchocerca volvulus Peroxidasin homolog 0.0063 0.0566 0.129
Loa Loa (eye worm) hypothetical protein 0.0152 0.1679 0.2165
Trypanosoma cruzi cytochrome P450, putative 0.002 0.0023 0.051
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0101 0.1043 0.4544
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0054 0.045 0.5
Onchocerca volvulus Peroxidasin homolog 0.0063 0.0566 0.129
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0314 0.137
Onchocerca volvulus Peroxidase homolog 0.0063 0.0566 0.129
Brugia malayi jmjC domain containing protein 0.0039 0.0261 0.0329
Echinococcus multilocularis endothelin converting enzyme 1 0.0201 0.2295 0.2289
Onchocerca volvulus 0.0286 0.3364 1
Brugia malayi Pre-SET motif family protein 0.0036 0.0221 0.0277
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0175 0.0123
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0171 0.0111
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0072 0.0674 0.2915
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.031 0.0542
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.0002
Loa Loa (eye worm) hypothetical protein 0.0149 0.1635 0.2108
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0054 0.045 1
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0049 0.0383 0.167
Brugia malayi Cytochrome P450 family protein 0.002 0.0023 0.002
Onchocerca volvulus 0.0063 0.0566 0.129
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Brugia malayi PHD-finger family protein 0.003 0.0146 0.018
Loa Loa (eye worm) hypothetical protein 0.0043 0.0314 0.0398
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0049 0.0383 0.167
Brugia malayi Peptidase family M13 containing protein 0.0201 0.2295 0.2962
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0285 0.036
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0101 0.1043 0.4544
Loa Loa (eye worm) animal heme peroxidase 0.0063 0.0566 0.0723
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0052 0.0427 0.1862
Echinococcus granulosus methyl CpG binding domain protein 2 0.0021 0.0027 0.0085
Loa Loa (eye worm) beta-lactamase 0.0043 0.0314 0.0398
Trichomonas vaginalis PIKK family atypical protein kinase 0.0046 0.035 0.0665
Loa Loa (eye worm) phosphatidylinositol 3 0.0054 0.045 0.0573
Plasmodium falciparum phd finger protein, putative 0.0031 0.0152 0.5
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0054 0.045 0.0573
Onchocerca volvulus Peroxidase homolog 0.0063 0.0566 0.129
Onchocerca volvulus 0.01 0.102 0.2703
Toxoplasma gondii target of rapamycin (TOR), putative 0.004 0.0275 0.0576
Brugia malayi Peroxidasin 0.0063 0.0566 0.0723
Schistosoma mansoni hypothetical protein 0.0031 0.0152 0.0661
Echinococcus granulosus peroxidasin 0.0063 0.0566 0.2442
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0566 0.0723
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0031 0.0152 0.0661
Onchocerca volvulus 0.0043 0.0314 0.0506
Schistosoma mansoni hypothetical protein 0.0052 0.0427 0.1862
Loa Loa (eye worm) hypothetical protein 0.0049 0.0386 0.0491
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.0171 0.0111
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0275 0.0432
Schistosoma mansoni hypothetical protein 0.0052 0.0427 0.1862
Loa Loa (eye worm) hypothetical protein 0.0052 0.0415 0.0528
Brugia malayi peptidase family M13 containing protein 0.0049 0.0383 0.0487
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0314 0.0398
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0314 0.0554
Schistosoma mansoni peroxidasin 0.0063 0.0566 0.2466
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.0225 0.0278
Echinococcus multilocularis PHD finger protein rhinoceros 0.0031 0.0152 0.0145
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0201 0.2295 1
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Brugia malayi Bromodomain containing protein 0.0091 0.0906 0.1164
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0027 0.0116
Brugia malayi Angiotensin-converting enzyme family protein 0.0633 0.7732 1
Mycobacterium ulcerans esterase/lipase LipP 0.0043 0.0314 0.0878
Schistosoma mansoni hypothetical protein 0.0019 0.0007 0.0031
Echinococcus multilocularis peregrin 0.0033 0.0188 0.0181
Brugia malayi Hypothetical zinc metalloproteinase T16A9.4 0.0201 0.2295 0.2962
Loa Loa (eye worm) hypothetical protein 0.0201 0.2295 0.2962
Schistosoma mansoni family M13 unassigned peptidase (M13 family) 0.0049 0.0383 0.167
Schistosoma mansoni jumonji domain containing protein 0.0079 0.0767 0.3341
Loa Loa (eye worm) jmjC domain-containing protein 0.0039 0.0261 0.0329
Schistosoma mansoni family M13 non-peptidase homologue (M13 family) 0.0049 0.0383 0.167
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.326 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0152 0.0187
Loa Loa (eye worm) hypothetical protein 0.0201 0.2295 0.2962
Onchocerca volvulus 0.0043 0.0314 0.0506
Onchocerca volvulus 0.0043 0.0314 0.0506
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0072 0.0674 0.0667
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0212 0.4709
Loa Loa (eye worm) hypothetical protein 0.0041 0.0285 0.036
Loa Loa (eye worm) hypothetical protein 0.0152 0.1679 0.2165
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0525 0.067
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0036 0.0221 0.0963
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0275 0.0432
Echinococcus granulosus jumonji domain containing protein 0.0043 0.0302 0.1289
Onchocerca volvulus 0.0036 0.0221 0.0216
Mycobacterium ulcerans lipase LipD 0.0043 0.0314 0.0878
Loa Loa (eye worm) hypothetical protein 0.0043 0.0314 0.0398
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0054 0.045 0.5
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0054 0.045 1
Echinococcus granulosus peregrin 0.0033 0.0188 0.0789
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.031 0.0542
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.048 0.2091
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0566 0.0723
Brugia malayi beta-lactamase family protein 0.0043 0.0314 0.0398
Onchocerca volvulus 0.0063 0.0566 0.129
Schistosoma mansoni methyl-cpg binding protein mbd 0.0021 0.0027 0.0116
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0054 0.045 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0043 0.0313 0.1338
Loa Loa (eye worm) PHD-finger family protein 0.0025 0.0081 0.0096
Schistosoma mansoni jumonji/arid domain-containing protein 0.0039 0.0261 0.1139
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.031 0.0542
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0314 0.0554
Loa Loa (eye worm) animal heme peroxidase 0.0063 0.0566 0.0723
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.045 0.0974
Loa Loa (eye worm) hypothetical protein 0.0149 0.1635 0.2108
Loa Loa (eye worm) hypothetical protein 0.0152 0.1679 0.2165
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0525 0.067
Loa Loa (eye worm) hypothetical protein 0.0201 0.2295 0.2962
Echinococcus granulosus histone lysine methyltransferase setb 0.0057 0.048 0.2066
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0275 0.0432
Trichomonas vaginalis esterase, putative 0.0043 0.0314 0.0554
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0251 0.2927 0.378
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Leishmania major cytochrome p450-like protein 0.002 0.0023 0.051
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0054 0.045 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.031 0.0542
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0314 0.0554
Schistosoma mansoni hypothetical protein 0.0052 0.0427 0.1862
Echinococcus granulosus endothelin converting enzyme 1 0.0201 0.2295 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0043 0.0314 0.0878
Schistosoma mansoni Nep2 peptidase (M13 family) 0.0101 0.1043 0.4544
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0054 0.045 0.1961
Trichomonas vaginalis PIKK family atypical protein kinase 0.0043 0.031 0.0542
Brugia malayi Cytochrome P450 family protein 0.002 0.0023 0.002
Brugia malayi Pre-SET motif family protein 0.0251 0.2927 0.378
Loa Loa (eye worm) zinc metallopeptidase 4 0.0049 0.0383 0.0487
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0314 0.1342
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.0136 0.0002
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.045 0.0974
Schistosoma mansoni neprilysin-2 (M13 family) 0.0101 0.1043 0.4544
Loa Loa (eye worm) hypothetical protein 0.0052 0.0426 0.0542
Loa Loa (eye worm) hypothetical protein 0.0043 0.0314 0.0398
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0314 0.6985
Schistosoma mansoni hypothetical protein 0.0041 0.0285 0.1242
Onchocerca volvulus 0.0063 0.0566 0.129
Loa Loa (eye worm) hypothetical protein 0.0046 0.035 0.0444
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0043 0.0311 0.691
Brugia malayi Cytochrome P450 family protein 0.0031 0.0159 0.0196
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0057 0.048 0.2091
Schistosoma mansoni hypothetical protein 0.0019 0.0007 0.0031
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0057 0.048 0.0473
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0314 1
Brugia malayi Bromodomain containing protein 0.0033 0.0188 0.0234
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0212 0.4709
Echinococcus multilocularis peroxidasin 0.0063 0.0566 0.0559
Brugia malayi beta-lactamase family protein 0.0043 0.0314 0.0398
Loa Loa (eye worm) hypothetical protein 0.0085 0.0841 0.108
Trichomonas vaginalis PIKK family atypical protein kinase 0.004 0.0275 0.0432
Schistosoma mansoni jumonji/arid domain-containing protein 0.0039 0.0261 0.1139
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Echinococcus granulosus zinc finger protein 0.0024 0.0065 0.0252
Echinococcus multilocularis jumonji domain containing protein 0.0043 0.0302 0.0295
Loa Loa (eye worm) hypothetical protein 0.0063 0.0566 0.0723
Schistosoma mansoni bromodomain containing protein 0.0076 0.0728 0.3174
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0054 0.045 1
Giardia lamblia GTOR 0.0054 0.045 1
Echinococcus granulosus lysine specific demethylase 5A 0.0039 0.0261 0.1111
Loa Loa (eye worm) hypothetical protein 0.0152 0.1679 0.2165
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0043 0.0313 0.0306
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0314 0.0307
Loa Loa (eye worm) CYP4Cod1 0.002 0.0023 0.002
Leishmania major hypothetical protein, conserved 0.0043 0.0314 0.6985
Schistosoma mansoni endothelin-converting enzyme-like 1 (damage-induced neuronal endopeptidase) 0.0049 0.0383 0.167
Trichomonas vaginalis PIKK family atypical protein kinase 0.0035 0.0211 0.0233
Trichomonas vaginalis PIKK family atypical protein kinase 0.0054 0.045 0.0974
Brugia malayi Animal haem peroxidase family protein 0.0063 0.0566 0.0723
Echinococcus multilocularis zinc finger protein 0.0024 0.0065 0.0058

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 1.2589 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference
Potency (functional) 1.4125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) = 2.8184 um PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] ChEMBL. No reference
Potency (functional) 4.14 uM PUBCHEM_BIOASSAY: Acumen qHTS Assay for Inhibitors of the mTORC1 Signaling Pathway in MEF (Tsc2-/-, p53-/-) Cells: Sytravon. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID2660, AID2666, AID2667, AID2668, AID2681, AID504465] ChEMBL. No reference
Potency (functional) 7.9433 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 10 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 79.4328 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 89.1251 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens 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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