Detailed information for compound 784637

Basic information

Technical information
  • TDR Targets ID: 784637
  • Name: N-[(3-bromo-4-methoxyphenyl)methylideneamino] -2-(3-nitrophenoxy)acetamide
  • MW: 408.203 | Formula: C16H14BrN3O5
  • H donors: 1 H acceptors: 3 LogP: 3.36 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1Br)C=NNC(=O)COc1cccc(c1)[N+](=O)[O-]
  • InChi: 1S/C16H14BrN3O5/c1-24-15-6-5-11(7-14(15)17)9-18-19-16(21)10-25-13-4-2-3-12(8-13)20(22)23/h2-9H,10H2,1H3,(H,19,21)/b18-9+
  • InChiKey: GKLFPOONXQYUKZ-GIJQJNRQSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[(3-bromo-4-methoxy-phenyl)methyleneamino]-2-(3-nitrophenoxy)acetamide
  • N-[(3-bromo-4-methoxyphenyl)methyleneamino]-2-(3-nitrophenoxy)acetamide
  • N-[(3-bromo-4-methoxy-benzylidene)amino]-2-(3-nitrophenoxy)acetamide
  • N-[(3-bromo-4-methoxy-phenyl)methylideneamino]-2-(3-nitrophenoxy)ethanamide
  • A0663/0030846

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
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.4044 0.3315
Schistosoma mansoni kinase 0.0047 0.1167 0.2887
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.1027 0.138
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1027 0.254
Echinococcus multilocularis muscleblind protein 1 0.0146 0.7444 1
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0092 0.4044 0.5432
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0093 0.4107 0.5517
Plasmodium falciparum enoyl-acyl carrier reductase 0.0187 1 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0059 0.1922 0.2582
Brugia malayi jmjC domain containing protein 0.0035 0.038 0.051
Loa Loa (eye worm) jmjC domain-containing protein 0.0035 0.038 0.051
Entamoeba histolytica serine/threonine protein kinase, putative 0.0092 0.4044 0.5
Echinococcus multilocularis muscleblind protein 0.0146 0.7444 1
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0187 1 0.5
Schistosoma mansoni jumonji domain containing protein 0.0074 0.2892 0.7152
Schistosoma mansoni jumonji/arid domain-containing protein 0.0035 0.038 0.0939
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.1027 0.138
Loa Loa (eye worm) hypothetical protein 0.0146 0.7444 1
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0092 0.4044 0.5
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0092 0.4044 0.5432
Schistosoma mansoni serine/threonine protein kinase 0.0092 0.4044 1
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0187 1 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.129 0.1732
Trypanosoma cruzi polo-like protein kinase, putative 0.0092 0.4044 0.5
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.4044 0.3315
Giardia lamblia Kinase, PLK 0.0092 0.4044 1
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.4044 0.3315
Echinococcus multilocularis lysine specific demethylase 5A 0.0035 0.038 0.051
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.1027 0.138
Brugia malayi serine/threonine-protein kinase plk-2 0.0092 0.4044 0.5432
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0187 1 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.1027 0.138
Trypanosoma cruzi polo-like protein kinase, putative 0.0092 0.4044 0.5
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0093 0.4107 0.5517
Echinococcus granulosus jumonji domain containing protein 0.004 0.0707 0.095
Brugia malayi jmjC domain containing protein 0.0093 0.4107 0.5517
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.4044 0.3315
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.4044 0.3315
Schistosoma mansoni jumonji/arid domain-containing protein 0.0035 0.038 0.0939
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.1027 0.138
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.4044 0.3315
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0187 1 0.5
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0092 0.4044 0.5432
Trichomonas vaginalis CAMK family protein kinase 0.0092 0.4044 0.3315
Echinococcus granulosus muscleblind protein 0.0146 0.7444 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.1027 0.138
Onchocerca volvulus Serine\/threonine kinase homolog 0.0092 0.4044 1
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0187 1 1
Loa Loa (eye worm) hypothetical protein 0.0146 0.7444 1
Trichomonas vaginalis hypothetical protein 0.0187 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1027 0.254
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0187 1 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1027 0.254
Brugia malayi Muscleblind-like protein 0.0146 0.7444 1
Echinococcus granulosus lysine specific demethylase 5A 0.0035 0.038 0.051
Echinococcus multilocularis jumonji domain containing protein 0.004 0.0707 0.095
Trypanosoma brucei polo-like protein kinase 0.0092 0.4044 0.5

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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