Detailed information for compound 838321

Basic information

Technical information
  • TDR Targets ID: 838321
  • Name: 4-bromo-N-[(3-iodo-4-methoxyphenyl)methyliden eamino]benzamide
  • MW: 459.076 | Formula: C15H12BrIN2O2
  • H donors: 1 H acceptors: 1 LogP: 4.14 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1I)C=NNC(=O)c1ccc(cc1)Br
  • InChi: 1S/C15H12BrIN2O2/c1-21-14-7-2-10(8-13(14)17)9-18-19-15(20)11-3-5-12(16)6-4-11/h2-9H,1H3,(H,19,20)/b18-9-
  • InChiKey: WXBUOPZJFVJPPU-NVMNQCDNSA-N  

Network

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Synonyms

  • 4-bromo-N-[(3-iodo-4-methoxy-phenyl)methyleneamino]benzamide
  • 4-bromo-N-[(3-iodo-4-methoxyphenyl)methyleneamino]benzamide
  • 4-bromo-N-[(3-iodo-4-methoxy-benzylidene)amino]benzamide
  • 4-bromo-N-[(3-iodo-4-methoxy-phenyl)methylideneamino]benzamide
  • A1567/0068294
  • BIM-0021452.P001
  • AG-205/11116919

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 0.0026 0.0127 0.0137
Loa Loa (eye worm) hypothetical protein 0.0026 0.0127 0.0137
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0056 0.0709 0.2473
Echinococcus multilocularis survival motor neuron protein 1 0.0156 0.2651 0.2556
Brugia malayi Carboxylesterase family protein 0.0026 0.0127 0.004
Schistosoma mansoni survival motor neuron protein 0.0032 0.0242 0.061
Echinococcus granulosus survival motor neuron protein 1 0.0156 0.2651 0.2776
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0041 0.0423 0.0301
Brugia malayi Carboxylesterase family protein 0.0026 0.0127 0.004
Loa Loa (eye worm) carboxylesterase 0.0153 0.2592 0.2812
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0044 0.0488 0.0437
Loa Loa (eye worm) hypothetical protein 0.0493 0.9218 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0039 0.0383 0.026
Echinococcus granulosus metabotropic glutamate receptor 5 0.006 0.0798 0.0739
Loa Loa (eye worm) carboxylesterase 0.0026 0.0127 0.0137
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0026 0.0127 0.5
Loa Loa (eye worm) carboxylesterase 0.0026 0.0127 0.0137
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0032 0.0242 0.0167
Loa Loa (eye worm) hypothetical protein 0.0153 0.2592 0.2812
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0039 0.0383 0.1172
Onchocerca volvulus 0.0032 0.0242 1
Echinococcus granulosus metabotropic glutamate receptor 2 0.0041 0.0423 0.0326
Brugia malayi Carboxylesterase family protein 0.0026 0.0127 0.004
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0039 0.0383 0.0321
Echinococcus multilocularis muscleblind protein 0.0493 0.9218 0.9208
Echinococcus granulosus muscleblind protein 0.0493 0.9218 1
Echinococcus multilocularis acetylcholinesterase 0.0153 0.2592 0.2498
Loa Loa (eye worm) glutamate receptor 0.0049 0.0578 0.0627
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0039 0.0383 0.026
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0039 0.0383 0.0282
Loa Loa (eye worm) hypothetical protein 0.0026 0.0127 0.0137
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0026 0.0127 0.0148
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0039 0.0383 0.0282
Trichomonas vaginalis carboxylesterase domain containing protein, putative 0.0026 0.0127 0.5
Brugia malayi Carboxylesterase family protein 0.0153 0.2592 0.2742
Brugia malayi Metabotropic glutamate receptor precursor. 0.0049 0.0578 0.0535
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0026 0.0127 0.0148
Loa Loa (eye worm) hypothetical protein 0.0026 0.0127 0.0137
Echinococcus granulosus acetylcholinesterase 0.0153 0.2592 0.2712
Trichomonas vaginalis spcc417.12 protein, putative 0.0026 0.0127 0.5
Loa Loa (eye worm) hypothetical protein 0.0026 0.0127 0.0137
Brugia malayi Carboxylesterase family protein 0.0153 0.2592 0.2742
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0039 0.0383 0.0415
Schistosoma mansoni neuroligin 3 (S09 family) 0.0026 0.0127 0.0148
Echinococcus multilocularis muscleblind protein 1 0.0493 0.9218 0.9208
Schistosoma mansoni gliotactin 0.0026 0.0127 0.0148
Schistosoma mansoni BC026374 protein (S09 family) 0.0026 0.0127 0.0148
Brugia malayi Muscleblind-like protein 0.0493 0.9218 1
Brugia malayi hypothetical protein 0.0026 0.0127 0.004
Echinococcus granulosus carboxylesterase 5A 0.0153 0.2592 0.2712
Loa Loa (eye worm) hypothetical protein 0.0026 0.0127 0.0137
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0039 0.0383 0.1172
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0026 0.0127 0.0148
Loa Loa (eye worm) hypothetical protein 0.0156 0.2651 0.2875
Schistosoma mansoni metabotropic glutamate receptor 0.0041 0.0423 0.1333
Echinococcus multilocularis carboxylesterase 5A 0.0153 0.2592 0.2498
Echinococcus multilocularis acetylcholinesterase 0.0153 0.2592 0.2498
Brugia malayi Carboxylesterase family protein 0.0026 0.0127 0.004
Echinococcus multilocularis metabotropic glutamate receptor 5 0.006 0.0798 0.068
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0026 0.0127 0.5
Schistosoma mansoni hypothetical protein 0.0032 0.0242 0.061
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0039 0.0383 0.1172
Brugia malayi hypothetical protein 0.0156 0.2651 0.2806
Mycobacterium tuberculosis Carboxylesterase LipT 0.0026 0.0127 0.5
Echinococcus granulosus acetylcholinesterase 0.0153 0.2592 0.2712
Loa Loa (eye worm) hypothetical protein 0.0026 0.0127 0.0137
Schistosoma mansoni acetylcholinesterase 0.0026 0.0127 0.0148
Mycobacterium ulcerans carboxylesterase, LipT 0.0026 0.0127 0.5
Loa Loa (eye worm) acetylcholinesterase 1 0.0153 0.2592 0.2812
Loa Loa (eye worm) hypothetical protein 0.0153 0.2592 0.2812
Loa Loa (eye worm) hypothetical protein 0.006 0.0798 0.0866
Loa Loa (eye worm) hypothetical protein 0.0493 0.9218 1
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0153 0.2592 1

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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