Detailed information for compound 280767

Basic information

Technical information
  • TDR Targets ID: 280767
  • Name: ethyl N-[[3-(2,3-dihydroindol-1-yl)phenyl]met hyl]carbamate
  • MW: 296.364 | Formula: C18H20N2O2
  • H donors: 1 H acceptors: 1 LogP: 3.52 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)NCc1cccc(c1)N1CCc2c1cccc2
  • InChi: 1S/C18H20N2O2/c1-2-22-18(21)19-13-14-6-5-8-16(12-14)20-11-10-15-7-3-4-9-17(15)20/h3-9,12H,2,10-11,13H2,1H3,(H,19,21)
  • InChiKey: NYGBOZSOFJECMU-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • ethyl N-[(3-indolin-1-ylphenyl)methyl]carbamate
  • N-[[3-(1-indolinyl)phenyl]methyl]carbamic acid ethyl ester
  • N-(3-indolin-1-ylbenzyl)carbamic acid ethyl 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
Echinococcus multilocularis tyrosine protein kinase HCK 0.0143 0.1469 0.1469
Echinococcus multilocularis tyrosine protein kinase Srms 0.0232 0.5788 0.5788
Echinococcus granulosus tyrosine protein kinase Blk 0.0232 0.5788 0.5788
Echinococcus multilocularis tyrosine protein kinase Blk 0.0232 0.5788 0.5788
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0318 1 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0232 0.5788 0.5788
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0318 1 1
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0318 1 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0318 1 1
Loa Loa (eye worm) TK protein kinase 0.0143 0.1469 0.1469
Loa Loa (eye worm) sex muscle abnormal protein 5 0.0175 0.2999 0.2999
Schistosoma mansoni growth factor receptor-bound protein 0.0175 0.2999 0.2999
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0318 1 1
Schistosoma mansoni nck2/grb4 0.0175 0.2999 0.2999
Echinococcus granulosus growth factor receptor bound protein 2 0.0175 0.2999 0.2999
Echinococcus granulosus tyrosine protein kinase Src64B 0.0318 1 1
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0318 1 1
Brugia malayi Tyrosine-protein kinase abl-1 0.0199 0.4212 0.4212
Echinococcus granulosus tyrosine protein kinase Fyn 0.0318 1 1
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0318 1 1
Echinococcus multilocularis c src tyrosine kinase 0.0199 0.4212 0.4212
Schistosoma mansoni adapter molecule crk 0.0175 0.2999 0.2999
Echinococcus granulosus c src tyrosine kinase 0.0199 0.4212 0.4212
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0318 1 1
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0232 0.5788 0.5788
Echinococcus granulosus tyrosine kinase 0.0232 0.5788 0.5788
Onchocerca volvulus 0.0113 0 0.5
Onchocerca volvulus 0.0113 0 0.5
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0175 0.2999 0.2999
Echinococcus granulosus tyrosine protein kinase Src42A 0.0207 0.4576 0.4576
Brugia malayi Sex muscle abnormal protein 5 0.0175 0.2999 0.2999
Echinococcus multilocularis growth factor receptor bound protein 2 0.0175 0.2999 0.2999
Loa Loa (eye worm) TK protein kinase 0.0232 0.5788 0.5788
Schistosoma mansoni tyrosine kinase 0.0318 1 1
Loa Loa (eye worm) SRC-1 0.0318 1 1
Entamoeba histolytica protein kinase, putative 0.0143 0.1469 1
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0199 0.4212 0.4212
Onchocerca volvulus 0.0113 0 0.5
Echinococcus granulosus tyrosine protein kinase Lyn 0.0318 1 1
Echinococcus granulosus tyrosine protein kinase Src42A 0.0318 1 1
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.0175 0.2999 0.2999
Schistosoma mansoni growth factor receptor-bound protein 0.0175 0.2999 0.2999
Brugia malayi protein-tyrosine kinase 0.0232 0.5788 0.5788
Schistosoma mansoni tyrosine kinase 0.0199 0.4212 0.4212
Echinococcus granulosus tyrosine protein kinase Fyn 0.0318 1 1
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0318 1 1
Brugia malayi Variant SH3 domain containing protein 0.0175 0.2999 0.2999
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0207 0.4576 0.4576
Echinococcus granulosus tyrosine protein kinase Fyn 0.0318 1 1
Brugia malayi Variant SH3 domain containing protein 0.0175 0.2999 0.2999
Onchocerca volvulus 0.0113 0 0.5
Onchocerca volvulus 0.0113 0 0.5
Echinococcus multilocularis tyrosine protein kinase Abl 0.0199 0.4212 0.4212
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0199 0.4212 0.4212
Schistosoma mansoni tyrosine kinase 0.0318 1 1
Onchocerca volvulus 0.0113 0 0.5
Echinococcus multilocularis NCK adaptor protein 0.0175 0.2999 0.2999
Echinococcus granulosus NCK adaptor protein 0.0175 0.2999 0.2999
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0199 0.4212 0.4212
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0318 1 1
Schistosoma mansoni tyrosine kinase 0.0199 0.4212 0.4212
Echinococcus granulosus tyrosine protein kinase HCK 0.0143 0.1469 0.1469
Loa Loa (eye worm) hypothetical protein 0.0175 0.2999 0.2999
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0318 1 1

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) = 34 % inhibition of PQW-writhing in mice on subcutaneous administration at dose 10 mg/kg. compound showed slight activity in the range of 10-34%, ChEMBL. 3965715
Inhibition (functional) = 34 % inhibition of PQW-writhing in mice on subcutaneous administration at dose 10 mg/kg. compound showed slight activity in the range of 10-34%, ChEMBL. 3965715

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

1 literature reference was collected for this gene.

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