Detailed information for compound 1765555

Basic information

Technical information
  • TDR Targets ID: 1765555
  • Name: 2-methoxy-N-(pyridin-2-ylmethylideneamino)ben zamide
  • MW: 255.272 | Formula: C14H13N3O2
  • H donors: 1 H acceptors: 2 LogP: 2.07 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1C(=O)N/N=C/c1ccccn1
  • InChi: 1S/C14H13N3O2/c1-19-13-8-3-2-7-12(13)14(18)17-16-10-11-6-4-5-9-15-11/h2-10H,1H3,(H,17,18)/b16-10+
  • InChiKey: MVGFYITWPLKZGF-MHWRWJLKSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-methoxy-N-(2-pyridylmethyleneamino)benzamide

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
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0498 0.0572
Mycobacterium ulcerans beta-lactamase 0.0036 0 0.5
Onchocerca volvulus 0.0036 0 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0036 0 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0498 0.0498
Onchocerca volvulus 0.0036 0 0.5
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0498 0.0498
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0 0.5
Brugia malayi Serine/threonine-protein kinase SULU 0.0208 0.87 0.87
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0498 0.0572
Plasmodium vivax hypothetical protein, conserved 0.0036 0 0.5
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0 0.5
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0498 0.0572
Mycobacterium leprae Probable lipase LipE 0.0036 0 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0498 0.0572
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0233 1 1
Toxoplasma gondii ABC1 family protein 0.0036 0 0.5
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0232 0.9919 1
Mycobacterium ulcerans lipase LipD 0.0036 0 0.5
Mycobacterium ulcerans hypothetical protein 0.0036 0 0.5
Echinococcus multilocularis serine:threonine protein kinase TAO1 0.0208 0.87 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0498 0.0572
Mycobacterium leprae conserved hypothetical protein 0.0036 0 0.5
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0 0.5
Leishmania major hypothetical protein, conserved 0.0036 0 0.5
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0036 0 0.5
Onchocerca volvulus 0.0036 0 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0498 0.0572
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0 0.5
Trichomonas vaginalis esterase, putative 0.0036 0 0.5
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0498 0.0572
Mycobacterium ulcerans esterase/lipase LipP 0.0036 0 0.5
Echinococcus granulosus serine:threonine protein kinase TAO1 0.0208 0.87 1
Loa Loa (eye worm) STE/STE20/TAO protein kinase 0.0208 0.87 0.87
Schistosoma mansoni serine/threonine protein kinase 0.0208 0.87 1
Brugia malayi hypothetical protein 0.0208 0.87 0.87

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 59.97 uM Antileishmanial activity against promastigotes of Leishmania major after 72 hrs by Neubauer counting chamber-based microscopic analysis ChEMBL. 23608761

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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