Detailed information for compound 1781734

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 197.231 | Formula: C10H15NO3
  • H donors: 3 H acceptors: 2 LogP: 1.13 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OCC(CNc1ccccc1OC)O
  • InChi: 1S/C10H15NO3/c1-14-10-5-3-2-4-9(10)11-6-8(13)7-12/h2-5,8,11-13H,6-7H2,1H3
  • InChiKey: CYZWWNDOIPZOOI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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 granulosus fibroblast growth factor receptor 4 0.0126 0.206 0.2265
Echinococcus multilocularis fibroblast growth factor receptor 4 0.0126 0.206 0.2265
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0061 0.0371 0.0395
Schistosoma mansoni nephrin 0.0104 0.1479 0.1622
Schistosoma mansoni plexin 0.0158 0.2876 0.3169
Brugia malayi Furin-like cysteine rich region family protein 0.0398 0.9046 0.9045
Loa Loa (eye worm) hypothetical protein 0.0067 0.0545 0.0545
Schistosoma mansoni tyrosine kinase 0.0259 0.5463 0.6032
Brugia malayi Plexin repeat family protein 0.0158 0.2876 0.2867
Echinococcus multilocularis neuroglian 0.0089 0.1107 0.121
Schistosoma mansoni tyrosine kinase 0.023 0.4724 0.5214
Echinococcus multilocularis semaphorin 5B 0.0066 0.051 0.0549
Echinococcus multilocularis Immunoglobulin 0.0071 0.0627 0.0679
Loa Loa (eye worm) hypothetical protein 0.0047 0.0014 0.0014
Schistosoma mansoni tyrosine kinase 0.0126 0.206 0.2265
Loa Loa (eye worm) TK/EPH protein kinase 0.0108 0.1584 0.1584
Loa Loa (eye worm) hypothetical protein 0.0071 0.0627 0.0627
Loa Loa (eye worm) hypothetical protein 0.0066 0.051 0.051
Brugia malayi Sema domain containing protein 0.0066 0.051 0.0496
Schistosoma mansoni tyrosine kinase 0.0398 0.9046 1
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0071 0.0627 0.0679
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0061 0.0371 0.0395
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0061 0.0371 0.0395
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0061 0.0371 0.0395
Echinococcus granulosus tyrosine protein kinase Src42A 0.0061 0.0371 0.0395
Schistosoma mansoni tyrosine kinase 0.0054 0.0206 0.0212
Echinococcus granulosus insulin receptor 0.0259 0.5463 0.6032
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0071 0.0627 0.0679
Echinococcus multilocularis hypothetical protein 0.0066 0.051 0.0549
Echinococcus granulosus ephrin type A receptor 4 A 0.0089 0.1108 0.1212
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0061 0.0371 0.0395
Loa Loa (eye worm) TK/EGFR protein kinase 0.0398 0.9046 0.9046
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0084 0.0978 0.1068
Echinococcus multilocularis epidermal growth factor receptor 0.0398 0.9046 1
Onchocerca volvulus 0.0329 0.7269 0.8663
Loa Loa (eye worm) hypothetical protein 0.0085 0.0999 0.0999
Schistosoma mansoni cell adhesion molecule 0.0099 0.135 0.1479
Echinococcus granulosus basic fibroblast growth factor receptor 1 A 0.0126 0.206 0.2265
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0436 1 1
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0071 0.0627 0.0679
Loa Loa (eye worm) hypothetical protein 0.0071 0.0627 0.0627
Echinococcus granulosus tyrosine protein kinase Fyn 0.0061 0.0371 0.0395
Schistosoma mansoni plexin 0.0092 0.1178 0.1288
Schistosoma mansoni semaphorin 5-related 0.0066 0.051 0.0549
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0047 0.0014 0.0014
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0061 0.0371 0.0395
Brugia malayi Protein kinase domain containing protein 0.0098 0.1319 0.1307
Onchocerca volvulus Tyrosine kinase homolog 0.037 0.8313 1
Loa Loa (eye worm) sema domain-containing protein 0.0066 0.051 0.051
Onchocerca volvulus 0.0067 0.0545 0.0045
Loa Loa (eye worm) hypothetical protein 0.0103 0.1458 0.1458
Onchocerca volvulus 0.0158 0.2876 0.3033
Echinococcus granulosus tyrosine protein kinase Lyn 0.0061 0.0371 0.0395
Loa Loa (eye worm) plexin A 0.0187 0.3621 0.3621
Echinococcus granulosus tyrosine protein kinase Fyn 0.0061 0.0371 0.0395
Loa Loa (eye worm) TK/INSR protein kinase 0.0259 0.5463 0.5463
Echinococcus granulosus twitchin 0.0089 0.1107 0.121
Loa Loa (eye worm) hypothetical protein 0.0085 0.0999 0.0999
Loa Loa (eye worm) TK protein kinase 0.0053 0.0169 0.0169
Loa Loa (eye worm) TK protein kinase 0.0057 0.0271 0.0271
Loa Loa (eye worm) hypothetical protein 0.0066 0.051 0.051
Brugia malayi plexin A 0.0187 0.3621 0.3612
Loa Loa (eye worm) hypothetical protein 0.0066 0.051 0.051
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0057 0.0271 0.0285
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0273 0.5835 0.6444
Echinococcus granulosus plexin a4 0.0187 0.3621 0.3993
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0061 0.0371 0.0395
Echinococcus multilocularis epidermal growth factor receptor 0.0252 0.5287 0.5838
Echinococcus multilocularis Immunoglobulin 0.0071 0.0627 0.0679
Echinococcus multilocularis roundabout 2 0.0118 0.183 0.2011
Loa Loa (eye worm) hypothetical protein 0.0076 0.0755 0.0755
Schistosoma mansoni tyrosine kinase 0.0252 0.5287 0.5838
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0057 0.0271 0.0285
Echinococcus granulosus roundabout 2 0.0118 0.183 0.2011
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0061 0.0371 0.0395
Echinococcus granulosus tyrosine kinase 0.0057 0.0271 0.0285
Brugia malayi Protein kinase domain containing protein 0.0259 0.5463 0.5456
Echinococcus granulosus neuroglian 0.0089 0.1107 0.121
Echinococcus granulosus tyrosine protein kinase HCK 0.0053 0.0169 0.0171
Echinococcus granulosus epidermal growth factor receptor 0.0398 0.9046 1
Brugia malayi SRC-1 0.0061 0.0371 0.0358
Loa Loa (eye worm) hypothetical protein 0.0071 0.0627 0.0627
Schistosoma mansoni hypothetical protein 0.0066 0.051 0.0549
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0273 0.5835 0.6444
Brugia malayi Immunoglobulin I-set domain containing protein 0.0085 0.0999 0.0986
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0061 0.0371 0.0395
Echinococcus multilocularis ephrin type A receptor 4 A 0.0089 0.1108 0.1212
Echinococcus granulosus Immunoglobulin 0.0071 0.0627 0.0679
Brugia malayi ephrin receptor 1 precursor 0.0054 0.0192 0.0178
Loa Loa (eye worm) hypothetical protein 0.0084 0.0978 0.0978
Brugia malayi protein-tyrosine kinase 0.0057 0.0271 0.0258
Echinococcus granulosus epidermal growth factor receptor 0.0252 0.5287 0.5838
Echinococcus multilocularis basic fibroblast growth factor receptor 1 A 0.0126 0.206 0.2265
Brugia malayi hypothetical protein 0.0085 0.0999 0.0986
Echinococcus multilocularis plexin a4 0.0187 0.3621 0.3993
Entamoeba histolytica protein kinase, putative 0.0053 0.0169 1
Echinococcus multilocularis tyrosine protein kinase Srms 0.0057 0.0271 0.0285
Loa Loa (eye worm) hypothetical protein 0.0103 0.1458 0.1458
Schistosoma mansoni tyrosine kinase 0.023 0.4724 0.5214
Schistosoma mansoni hypothetical protein 0.0066 0.051 0.0549
Schistosoma mansoni ephrin receptor 0.0089 0.1108 0.1212
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0047 0.0014 0.0014
Schistosoma mansoni hypothetical protein 0.0092 0.1178 0.1288
Schistosoma mansoni tyrosine kinase 0.0252 0.5287 0.5838
Echinococcus multilocularis tyrosine protein kinase HCK 0.0053 0.0169 0.0171
Brugia malayi Fibronectin type III domain containing protein 0.0085 0.0999 0.0986
Echinococcus multilocularis insulin receptor 0.0259 0.5463 0.6032
Brugia malayi Immunoglobulin I-set domain containing protein 0.0145 0.254 0.2529
Echinococcus multilocularis 0.0116 0.1791 0.1968
Echinococcus granulosus defective proboscis extension response 0.0071 0.0627 0.0679
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0252 0.5287 0.5838
Loa Loa (eye worm) hypothetical protein 0.0066 0.051 0.051
Schistosoma mansoni tyrosine kinase 0.0061 0.0371 0.0395
Echinococcus granulosus semaphorin 5B 0.0066 0.051 0.0549
Brugia malayi hypothetical protein 0.0066 0.051 0.0496
Schistosoma mansoni vesicular amine transporter 0.0071 0.0627 0.0679
Schistosoma mansoni tyrosine kinase 0.023 0.4724 0.5214
Loa Loa (eye worm) hypothetical protein 0.0066 0.051 0.051
Echinococcus granulosus tyrosine protein kinase Blk 0.0057 0.0271 0.0285
Loa Loa (eye worm) hypothetical protein 0.0066 0.051 0.051
Loa Loa (eye worm) hypothetical protein 0.0158 0.2876 0.2876
Brugia malayi hypothetical protein 0.0066 0.051 0.0496
Loa Loa (eye worm) SRC-1 0.0061 0.0371 0.0371
Schistosoma mansoni tyrosine kinase 0.0259 0.5463 0.6032
Echinococcus granulosus tyrosine protein kinase Src64B 0.0061 0.0371 0.0395
Brugia malayi Sema domain containing protein 0.0066 0.051 0.0496
Schistosoma mansoni tyrosine kinase 0.0061 0.0371 0.0395
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0061 0.0371 0.0395
Echinococcus granulosus tyrosine protein kinase Fyn 0.0061 0.0371 0.0395
Echinococcus multilocularis tyrosine protein kinase Blk 0.0057 0.0271 0.0285
Loa Loa (eye worm) hypothetical protein 0.0092 0.1178 0.1178
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0061 0.0371 0.0395
Loa Loa (eye worm) sema domain-containing protein 0.0066 0.051 0.051
Loa Loa (eye worm) hypothetical protein 0.0085 0.0999 0.0999
Echinococcus granulosus semaphorin 1A 0.0066 0.051 0.0549
Loa Loa (eye worm) TK protein kinase 0.0145 0.254 0.254

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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