Detailed information for compound 910058

Basic information

Technical information
  • TDR Targets ID: 910058
  • Name: [[amino-(4-methoxyphenyl)methylidene]amino] 2 ,3-dimethoxybenzoate
  • MW: 330.335 | Formula: C17H18N2O5
  • H donors: 1 H acceptors: 1 LogP: 2.94 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)C(=N)NOC(=O)c1cccc(c1OC)OC
  • InChi: 1S/C17H18N2O5/c1-21-12-9-7-11(8-10-12)16(18)19-24-17(20)13-5-4-6-14(22-2)15(13)23-3/h4-10H,1-3H3,(H2,18,19)
  • InChiKey: HXLQYELHMVBDII-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • [[amino-(4-methoxyphenyl)methylene]amino] 2,3-dimethoxybenzoate
  • 2,3-dimethoxybenzoic acid [[amino-(4-methoxyphenyl)methylene]amino] ester

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) endoprotease bli-4 0.0478 1 1
Echinococcus multilocularis Peptidase S8 S53, subtilisin kexin sedolisin 0.002 0.0008 0.0009
Mycobacterium ulcerans proline rich membrane-anchored mycosin MycP5 0.002 0.0008 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Entamoeba histolytica PH domain containing protein kinase, putative 0.0022 0.0043 0.164
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Trypanosoma brucei rac serine-threonine kinase, putative 0.0032 0.0265 1
Brugia malayi neuroendocrine convertase 1 precursor 0.0301 0.6121 0.6118
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0291 0.5906 1
Mycobacterium ulcerans membrane-anchored serine protease (mycosin), MycP4 0.002 0.0008 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0113 0.2027 0.3423
Plasmodium falciparum subtilisin-like protease 3 0.002 0.0008 1
Brugia malayi celfurPC protein 0.0386 0.7981 0.7979
Loa Loa (eye worm) hypothetical protein 0.0478 1 1
Onchocerca volvulus 0.0047 0.0593 1
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Echinococcus granulosus serine/threonine protein kinase 0.0022 0.0043 0.0043
Giardia lamblia Furin precursor putative serine protease 0.0093 0.1581 0.4594
Echinococcus granulosus furin 0.0478 1 1
Schistosoma mansoni serine/threonine-protein kinase 0.0022 0.0043 0.0036
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Mycobacterium leprae PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5) 0.002 0.0008 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0113 0.2027 0.3423
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Plasmodium falciparum subtilisin-like protease 2 0.002 0.0008 1
Mycobacterium leprae Possible secreted protease 0.002 0.0008 0.5
Echinococcus multilocularis neuroendocrine convertase 2 0.0301 0.6121 0.767
Echinococcus granulosus proprotein convertase subtilisin:kexin type 5 0.0291 0.5906 0.5906
Mycobacterium ulcerans membrane-anchored mycosin MycP3 0.002 0.0008 0.5
Loa Loa (eye worm) AGC/AKT protein kinase 0.0032 0.0265 0.0257
Trichomonas vaginalis AGC family protein kinase 0.0032 0.0265 0.0436
Trichomonas vaginalis AGC family protein kinase 0.0032 0.0265 0.0436
Brugia malayi Protein kinase domain containing protein 0.0032 0.0265 0.0257
Trichomonas vaginalis AGC family protein kinase 0.0032 0.0265 0.0436
Schistosoma mansoni subfamily S8B non-peptidase homologue (S08 family) 0.0113 0.2027 0.2021
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0113 0.2027 0.3423
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0113 0.2027 0.3423
Trypanosoma cruzi Protein kinase B 0.0022 0.0043 1
Schistosoma mansoni tyrosine kinase 0.0113 0.2018 0.2012
Schistosoma mansoni furin-1 (S08 family) 0.0208 0.4102 0.4097
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4) 0.002 0.0008 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Brugia malayi proprotein convertase 2 0.0301 0.6121 0.6118
Echinococcus multilocularis epidermal growth factor receptor 0.0113 0.2018 0.2529
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Trichomonas vaginalis AGC family protein kinase 0.0032 0.0265 0.0436
Plasmodium falciparum subtilisin-like protease 1 0.002 0.0008 1
Loa Loa (eye worm) proprotein convertase 2 0.0113 0.2027 0.2021
Trypanosoma cruzi subtilisin peptidase 0.002 0.0008 0.1737
Mycobacterium tuberculosis Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like) 0.002 0.0008 0.5
Plasmodium vivax subtilisin-like protease 2, putative 0.002 0.0008 1
Loa Loa (eye worm) hypothetical protein 0.0188 0.3656 0.3651
Echinococcus multilocularis 0.0386 0.7981 1
Echinococcus multilocularis membrane bound transcription factor site 1 0.002 0.0008 0.0009
Entamoeba histolytica PH domain containing protein kinase, putative 0.0022 0.0043 0.164
Trichomonas vaginalis leucine-rich repeat protein, BspA family 0.0093 0.1581 0.2667
Loa Loa (eye worm) TK/EGFR protein kinase 0.0113 0.2018 0.2012
Schistosoma mansoni serine/threonine-protein kinase 0.0022 0.0043 0.0036
Trypanosoma cruzi rac serine-threonine kinase, putative 0.0022 0.0043 1
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0113 0.2027 0.3423
Echinococcus multilocularis proprotein convertase subtilisin:kexin type 5 0.0291 0.5906 0.74
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.002 0.0008 0.1737
Brugia malayi p70 ribosomal S6 kinase beta 0.003 0.0221 0.0214
Entamoeba histolytica protein kinase, putative 0.0032 0.0265 1
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.0478 1 1
Trichomonas vaginalis hypothetical protein 0.0093 0.1581 0.2667
Echinococcus granulosus Furin 1 0.0113 0.2027 0.2027
Toxoplasma gondii AGC kinase 0.003 0.0221 1
Echinococcus multilocularis Furin 1 0.0113 0.2027 0.2539
Mycobacterium tuberculosis Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5) 0.002 0.0008 0.5
Trichomonas vaginalis neuroendocrine convertase 2 precursor, putative 0.0093 0.1581 0.2667
Trichomonas vaginalis AGC family protein kinase 0.0032 0.0265 0.0436
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.002 0.0008 0.1737
Plasmodium vivax subtilisin-like protease 1 0.002 0.0008 1
Giardia lamblia High cysteine membrane protein Group 2 0.0178 0.344 1
Echinococcus granulosus neuroendocrine convertase 2 0.0301 0.6121 0.6121
Plasmodium vivax subtilisin-like serine protease, putative 0.002 0.0008 1
Trichomonas vaginalis AGC family protein kinase 0.0032 0.0265 0.0436
Mycobacterium leprae PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3) 0.002 0.0008 0.5
Schistosoma mansoni hypothetical protein 0.0093 0.1581 0.1574
Trichomonas vaginalis AGC family protein kinase 0.0032 0.0265 0.0436
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0291 0.5906 1
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3) 0.002 0.0008 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.0113 0.2027 0.3423
Echinococcus granulosus membrane bound transcription factor site 1 0.002 0.0008 0.0008
Entamoeba histolytica protein kinase, putative 0.0032 0.0265 1
Entamoeba histolytica protein kinase, putative 0.003 0.0221 0.836
Trypanosoma cruzi serine peptidase, clan SB, family S8-like protein 0.002 0.0008 0.1737
Leishmania major subtilisin-like serine peptidase 0.002 0.0008 0.5
Echinococcus multilocularis rac serine:threonine kinase 0.0022 0.0043 0.0054
Trichomonas vaginalis proprotein convertase subtilisin/kexin type, putative 0.0093 0.1581 0.2667
Echinococcus granulosus peptidase s8 s53 subtilisin kexin sedolisin 0.002 0.0008 0.0008
Trichomonas vaginalis conserved hypothetical protein 0.0093 0.1581 0.2667
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.003 0.0221 0.0214
Echinococcus granulosus epidermal growth factor receptor 0.0113 0.2018 0.2018
Brugia malayi Furin-like cysteine rich region family protein 0.0113 0.2018 0.2012

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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