Detailed information for compound 652346

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 270.283 | Formula: C15H14N2O3
  • H donors: 0 H acceptors: 2 LogP: 3.39 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccc(cc1)C=Nc1ccc(cc1)[N+](=O)[O-]
  • InChi: 1S/C15H14N2O3/c1-2-20-15-9-3-12(4-10-15)11-16-13-5-7-14(8-6-13)17(18)19/h3-11H,2H2,1H3/b16-11+
  • InChiKey: BPTOTKGOZHNMFL-LFIBNONCSA-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
Loa Loa (eye worm) hypothetical protein 0.0078 0.1384 0.1591
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0063 0.1084 0.1814
Echinococcus multilocularis snurportin 1 0.03 0.5978 1
Echinococcus granulosus lamin 0.0028 0.0362 0.0606
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0255 0.0371
Loa Loa (eye worm) hypothetical protein 0.0432 0.8696 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0053 0.0061
Schistosoma mansoni intermediate filament proteins 0.0028 0.0362 0.0606
Echinococcus granulosus geminin 0.0178 0.3455 0.578
Trichomonas vaginalis ran, putative 0.0021 0.0212 0.0585
Brugia malayi RNA recognition motif domain containing protein 0.0137 0.2607 0.2998
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0255 0.0934
Brugia malayi intermediate filament protein 0.0028 0.0362 0.0417
Mycobacterium ulcerans beta-lactamase 0.0078 0.1384 1
Loa Loa (eye worm) hypothetical protein 0.0013 0.0053 0.0061
Schistosoma mansoni ferritin light chain 0.0017 0.0139 0.0233
Mycobacterium ulcerans lipase LipD 0.0078 0.1384 1
Mycobacterium tuberculosis Conserved protein 0.0078 0.1384 0.1262
Schistosoma mansoni lozenge 0.0054 0.0903 0.151
Brugia malayi hypothetical protein 0.0231 0.4554 0.5237
Loa Loa (eye worm) hypothetical protein 0.0014 0.0064 0.0073
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0078 0.1384 1
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0362 0.0417
Trichomonas vaginalis penicillin-binding protein, putative 0.0078 0.1384 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0063 0.1084 0.1247
Echinococcus granulosus tar DNA binding protein 0.0137 0.2607 0.4361
Echinococcus multilocularis ferritin 0.0017 0.0139 0.0233
Echinococcus multilocularis geminin 0.0178 0.3455 0.578
Loa Loa (eye worm) hypothetical protein 0.0231 0.4554 0.5237
Echinococcus granulosus importin subunit beta 1 0.0028 0.0365 0.0611
Brugia malayi N-terminal motif family protein 0.0176 0.3417 0.3929
Brugia malayi hypothetical protein 0.0432 0.8696 1
Loa Loa (eye worm) hypothetical protein 0.0176 0.3417 0.3929
Schistosoma mansoni ferritin 0.0017 0.0139 0.0233
Loa Loa (eye worm) hypothetical protein 0.0028 0.0362 0.0417
Echinococcus granulosus beta LACTamase domain containing family member 0.0078 0.1384 0.2315
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0362 0.0417
Trichomonas vaginalis D-aminoacylase, putative 0.0078 0.1384 1
Mycobacterium tuberculosis Conserved protein 0.0078 0.1384 0.1262
Loa Loa (eye worm) hypothetical protein 0.0136 0.2592 0.2981
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0078 0.1384 0.1262
Mycobacterium tuberculosis Probable lipase LipD 0.0078 0.1384 0.1262
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0199 0.3892 0.4475
Schistosoma mansoni hypothetical protein 0.0047 0.0758 0.1267
Echinococcus granulosus ferritin 0.0017 0.0139 0.0233
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0365 0.1307
Echinococcus multilocularis GPCR, family 2 0.0063 0.1084 0.1814
Plasmodium vivax importin-beta 2, putative 0.0028 0.0365 0.1307
Mycobacterium tuberculosis Probable lipase LipE 0.0078 0.1384 0.1262
Schistosoma mansoni hypothetical protein 0.0178 0.3455 0.578
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0176 0.3417 0.3929
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0365 0.0611
Echinococcus multilocularis mucolipin 3 0.0067 0.1172 0.1961
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0078 0.1384 0.1262
Brugia malayi beta-lactamase 0.0078 0.1384 0.1591
Schistosoma mansoni hypothetical protein 0.0063 0.1084 0.1814
Mycobacterium tuberculosis Probable esterase LipL 0.0078 0.1384 0.1262
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0021 0.0212 0.0244
Echinococcus granulosus snurportin 1 0.03 0.5978 1
Onchocerca volvulus 0.0078 0.1384 0.1591
Schistosoma mansoni apoferritin-2 0.0017 0.0139 0.0233
Schistosoma mansoni ferritin 0.0017 0.0139 0.0233
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0199 0.3892 0.4475
Echinococcus granulosus GPCR family 2 0.0063 0.1084 0.1814
Mycobacterium leprae Probable lipase LipE 0.0078 0.1384 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0365 0.1307
Brugia malayi cytoplasmic intermediate filament protein 0.0015 0.0094 0.0108
Schistosoma mansoni tar DNA-binding protein 0.0137 0.2607 0.4361
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0021 0.0212 0.5
Loa Loa (eye worm) hypothetical protein 0.0199 0.3892 0.4475
Echinococcus multilocularis expressed protein 0.0017 0.0139 0.0233
Brugia malayi follicle stimulating hormone receptor 0.026 0.5144 0.5915
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0017 0.0139 0.5
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0063 0.1084 0.1814
Loa Loa (eye worm) beta-lactamase 0.0078 0.1384 0.1591
Mycobacterium ulcerans hypothetical protein 0.0078 0.1384 1
Trichomonas vaginalis penicillin-binding protein, putative 0.0078 0.1384 1
Echinococcus granulosus lamin dm0 0.0028 0.0362 0.0606
Schistosoma mansoni ferritin 0.0017 0.0139 0.0233
Mycobacterium ulcerans esterase/lipase LipP 0.0078 0.1384 1
Loa Loa (eye worm) hypothetical protein 0.0078 0.1384 0.1591
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0063 0.1084 0.1814
Entamoeba histolytica hypothetical protein 0.0023 0.0255 1
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0255 0.0934
Schistosoma mansoni tar DNA-binding protein 0.0137 0.2607 0.4361
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.03 0.5978 0.6874
Trichomonas vaginalis D-aminoacylase, putative 0.0078 0.1384 1
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0758 0.0871
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0078 0.1384 0.2315
Echinococcus granulosus intermediate filament protein 0.0028 0.0362 0.0606
Loa Loa (eye worm) hypothetical protein 0.0078 0.1384 0.1591
Schistosoma mansoni ferritin 0.0017 0.0139 0.0233
Brugia malayi Calcitonin receptor-like protein seb-1 0.0199 0.3892 0.4475
Mycobacterium tuberculosis Probable hydrolase 0.0078 0.1384 0.1262
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0063 0.1084 0.1247
Schistosoma mansoni ferritin light chain 0.0017 0.0139 0.0233
Loa Loa (eye worm) hypothetical protein 0.0078 0.1384 0.1591
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0014 0.0064 0.0107
Onchocerca volvulus 0.0078 0.1384 0.1591
Echinococcus multilocularis tar DNA binding protein 0.0137 0.2607 0.4361
Loa Loa (eye worm) RNA binding protein 0.0137 0.2607 0.2998
Onchocerca volvulus 0.0432 0.8696 1
Schistosoma mansoni lamin 0.0028 0.0362 0.0606
Echinococcus multilocularis lamin 0.0028 0.0362 0.0606
Trichomonas vaginalis D-aminoacylase, putative 0.0078 0.1384 1
Onchocerca volvulus 0.0078 0.1384 0.1591
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0078 0.1384 0.1591
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0078 0.1384 0.1262
Loa Loa (eye worm) hypothetical protein 0.0063 0.1084 0.1247
Trypanosoma cruzi hypothetical protein, conserved 0.0078 0.1384 1
Echinococcus multilocularis survival motor neuron protein 1 0.0231 0.4554 0.7618
Toxoplasma gondii ABC1 family protein 0.0078 0.1384 1
Brugia malayi Latrophilin receptor protein 2 0.0063 0.1084 0.1247
Loa Loa (eye worm) hypothetical protein 0.0078 0.1384 0.1591
Loa Loa (eye worm) runx1 0.0054 0.0903 0.1038
Mycobacterium leprae conserved hypothetical protein 0.0078 0.1384 1
Schistosoma mansoni tar DNA-binding protein 0.0137 0.2607 0.4361
Echinococcus granulosus expressed protein 0.0017 0.0139 0.0233
Schistosoma mansoni apoferritin-2 0.0017 0.0139 0.0233
Onchocerca volvulus 0.0028 0.0362 0.0417
Brugia malayi RNA, U transporter 1 0.008 0.1435 0.165
Trypanosoma cruzi hypothetical protein, conserved 0.0078 0.1384 1
Echinococcus granulosus GTP binding nuclear protein Ran 0.0021 0.0212 0.0355
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0365 0.1307
Echinococcus multilocularis Protein lozenge 0.0054 0.0903 0.151
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0137 0.2607 0.2998
Schistosoma mansoni ran 0.0021 0.0212 0.0355
Loa Loa (eye worm) follicle stimulating hormone receptor 0.026 0.5144 0.5915
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0255 0.0934
Loa Loa (eye worm) hypothetical protein 0.0028 0.0365 0.042
Echinococcus multilocularis beta LACTamase domain containing family member 0.0078 0.1384 0.2315
Plasmodium vivax hypothetical protein, conserved 0.0078 0.1384 1
Leishmania major importin beta-1 subunit, putative 0.0023 0.0255 0.0371
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0015 0.0094 0.0108
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0362 0.0417
Trichomonas vaginalis esterase, putative 0.0078 0.1384 1
Onchocerca volvulus 0.0028 0.0362 0.0417
Brugia malayi RNA binding protein 0.0137 0.2607 0.2998
Schistosoma mansoni hypothetical protein 0.0063 0.1084 0.1814
Echinococcus multilocularis musashi 0.0028 0.0362 0.0606
Schistosoma mansoni hypothetical protein 0.0063 0.1084 0.1814
Schistosoma mansoni hypothetical protein 0.0178 0.3455 0.578
Echinococcus granulosus mucolipin 3 0.0067 0.1172 0.1961
Schistosoma mansoni hypothetical protein 0.0136 0.2592 0.4336
Schistosoma mansoni importin beta-1 0.0028 0.0365 0.0611
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0078 0.1384 0.1591
Loa Loa (eye worm) mucolipin 1 0.0067 0.1172 0.1348
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0021 0.0212 0.0355
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0014 0.0064 0.0107
Plasmodium falciparum importin beta, putative 0.0028 0.0365 1
Leishmania major hypothetical protein, conserved 0.0078 0.1384 1
Loa Loa (eye worm) hypothetical protein 0.0027 0.0352 0.0405
Schistosoma mansoni lamin 0.0028 0.0362 0.0606
Mycobacterium tuberculosis Conserved protein 0.0078 0.1384 0.1262
Schistosoma mansoni tar DNA-binding protein 0.0137 0.2607 0.4361
Brugia malayi beta-lactamase family protein 0.0078 0.1384 0.1591
Brugia malayi Coelomocyte uptake defective protein 5 0.0067 0.1172 0.1348
Schistosoma mansoni hypothetical protein 0.03 0.5978 1
Brugia malayi TAR-binding protein 0.0137 0.2607 0.2998
Loa Loa (eye worm) hypothetical protein 0.0432 0.8696 1
Echinococcus granulosus survival motor neuron protein 1 0.0231 0.4554 0.7618
Brugia malayi beta-lactamase family protein 0.0078 0.1384 0.1591
Schistosoma mansoni tar DNA-binding protein 0.0137 0.2607 0.4361
Brugia malayi latrophilin 2 splice variant baaae 0.0136 0.2592 0.2981
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0078 0.1384 0.2315
Brugia malayi Importin beta-1 subunit 0.0028 0.0365 0.042
Loa Loa (eye worm) TAR-binding protein 0.0137 0.2607 0.2998
Schistosoma mansoni mucolipin 0.0062 0.1056 0.1767
Schistosoma mansoni mucolipin 0.0067 0.1172 0.1961
Schistosoma mansoni ran 0.0021 0.0212 0.0355
Trypanosoma brucei hypothetical protein, conserved 0.0078 0.1384 1
Schistosoma mansoni survival motor neuron protein 0.0047 0.0758 0.1267
Schistosoma mansoni hypothetical protein 0.0063 0.1084 0.1814
Echinococcus multilocularis lamin dm0 0.0028 0.0362 0.0606
Loa Loa (eye worm) hypothetical protein 0.0078 0.1384 0.1591
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0021 0.0212 0.0244
Treponema pallidum bacterioferrin (TpF1) 0.0017 0.0139 0.5
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0063 0.1084 0.1814
Onchocerca volvulus 0.0047 0.0758 0.0871

Activities

No activities found for this compound.

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

External resources for this compound

Bibliographic References

No literature references available for this target.

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