Detailed information for compound 657107

Basic information

Technical information
  • TDR Targets ID: 657107
  • Name: N-[(2,3-dimethoxyphenyl)methylideneamino]-2-t hiophen-2-ylacetamide
  • MW: 304.364 | Formula: C15H16N2O3S
  • H donors: 1 H acceptors: 1 LogP: 2.43 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1c(C=NNC(=O)Cc2cccs2)cccc1OC
  • InChi: 1S/C15H16N2O3S/c1-19-13-7-3-5-11(15(13)20-2)10-16-17-14(18)9-12-6-4-8-21-12/h3-8,10H,9H2,1-2H3,(H,17,18)/b16-10-
  • InChiKey: QWLXQAHXPNYDPD-YBEGLDIGSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • N-[(2,3-dimethoxyphenyl)methyleneamino]-2-(2-thienyl)acetamide
  • N-[(2,3-dimethoxybenzylidene)amino]-2-(2-thienyl)acetamide
  • N-[(2,3-dimethoxyphenyl)methylideneamino]-2-thiophen-2-yl-ethanamide
  • STK052207
  • ZINC00553361

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
Onchocerca volvulus 0.0148 0.5199 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0603 0.0603
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0226 0.8298 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0745 0.0126
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0679 0.0818
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0679 0.0441
Mycobacterium ulcerans hypothetical protein 0.0035 0.0679 0.0679
Loa Loa (eye worm) hypothetical protein 0.0035 0.0679 0.0679
Brugia malayi beta-lactamase family protein 0.0035 0.0679 0.0441
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.1223 0.1223
Loa Loa (eye worm) hypothetical protein 0.0035 0.0679 0.0679
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0025 0.0249 0.03
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0679 0.1186
Leishmania major hypothetical protein, conserved 0.0035 0.0679 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.1223 0.0999
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0162 0.5726 0.5
Mycobacterium ulcerans beta-lactamase 0.0035 0.0679 0.0679
Mycobacterium ulcerans hypothetical protein 0.0025 0.0249 0.0249
Loa Loa (eye worm) hypothetical protein 0.0025 0.0249 0.0249
Echinococcus multilocularis peptidase Clp (S14 family) 0.0106 0.35 0.5383
Loa Loa (eye worm) beta-lactamase 0.0035 0.0679 0.0679
Echinococcus multilocularis geminin 0.0166 0.5919 1
Entamoeba histolytica hypothetical protein 0.0037 0.0745 1
Trichomonas vaginalis glutaminase, putative 0.0268 1 1
Mycobacterium tuberculosis Conserved protein 0.0035 0.0679 0.0818
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0025 0.0249 0.03
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0056 0.1491 0.2268
Entamoeba histolytica hypothetical protein 0.0037 0.0745 1
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0106 0.35 0.4218
Loa Loa (eye worm) hypothetical protein 0.0025 0.0249 0.0249
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0679 0.008
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0249 0.0249
Loa Loa (eye worm) glutaminase 2 0.0268 1 1
Onchocerca volvulus 0.0035 0.0679 0.0869
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0056 0.1491 0.2604
Brugia malayi hypothetical protein 0.0037 0.0745 0.0509
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0162 0.5726 1
Loa Loa (eye worm) hypothetical protein 0.0148 0.5199 0.5199
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0056 0.1491 0.2604
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0025 0.0249 0.0249
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0679 0.5
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0025 0.0249 0.0249
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0162 0.5726 0.5726
Loa Loa (eye worm) hypothetical protein 0.0035 0.0679 0.0679
Mycobacterium ulcerans lipase LipD 0.0035 0.0679 0.0679
Loa Loa (eye worm) hypothetical protein 0.0025 0.0249 0.0249
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0745 0.0126
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0679 0.0679
Loa Loa (eye worm) hypothetical protein 0.0035 0.0679 0.0679
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0162 0.5726 0.5726
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0025 0.0249 0.0249
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0162 0.5726 1
Echinococcus granulosus peptidase Clp S14 family 0.0106 0.35 0.5383
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0679 0.0818
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0679 0.008
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0162 0.5726 0.9631
Onchocerca volvulus 0.0035 0.0679 0.0869
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0162 0.5726 1
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0162 0.5726 1
Echinococcus granulosus geminin 0.0166 0.5919 1
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0162 0.5726 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0249 0.0249
Loa Loa (eye worm) hypothetical protein 0.0242 0.8932 0.8932
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0679 0.5
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0162 0.5726 1
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0679 0.0679
Mycobacterium ulcerans glutaminase 0.0268 1 1
Schistosoma mansoni hypothetical protein 0.0037 0.0745 0.015
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0679 0.0679
Brugia malayi photoreceptor-specific nuclear receptor 0.0242 0.8932 0.8905
Loa Loa (eye worm) hypothetical protein 0.0035 0.0679 0.0679
Entamoeba histolytica hypothetical protein 0.0037 0.0745 1
Brugia malayi beta-lactamase family protein 0.0035 0.0679 0.0441
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0679 0.5
Loa Loa (eye worm) hypothetical protein 0.0049 0.1223 0.1223
Mycobacterium ulcerans acyl-CoA synthetase 0.0025 0.0249 0.0249
Loa Loa (eye worm) hypothetical protein 0.0162 0.5726 0.5726
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0679 0.0818
Brugia malayi Probable ClpP-like protease 0.0162 0.5726 0.5617
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0162 0.5726 1
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0603 0.0364
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0679 0.0785
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0025 0.0249 0.0249
Onchocerca volvulus 0.0035 0.0679 0.0869
Toxoplasma gondii hypothetical protein 0.0056 0.1491 0.1609
Mycobacterium tuberculosis Conserved protein 0.0035 0.0679 0.0818
Mycobacterium leprae Probable lipase LipE 0.0035 0.0679 0.0785
Brugia malayi beta-lactamase 0.0035 0.0679 0.0441
Schistosoma mansoni hypothetical protein 0.0166 0.5919 0.5657
Loa Loa (eye worm) glutaminase 0.0268 1 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0679 0.0679
Schistosoma mansoni glutaminase 0.0268 1 1
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0162 0.5726 0.9631
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0106 0.35 0.5936
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.1223 0.0999
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0106 0.35 0.4218
Schistosoma mansoni hypothetical protein 0.0166 0.5919 0.5657
Schistosoma mansoni peptidase Clp (S14 family) 0.0162 0.5726 0.5452
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0162 0.5726 1
Mycobacterium tuberculosis Conserved protein 0.0035 0.0679 0.0818
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0679 0.0818
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0679 0.0818
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0679 0.0818
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0745 0.015
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0679 0.0818
Brugia malayi hypothetical protein 0.0148 0.5199 0.5077
Entamoeba histolytica hypothetical protein 0.0037 0.0745 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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