Detailed information for compound 1512523

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 229.66 | Formula: C10H12ClNO3
  • H donors: 2 H acceptors: 2 LogP: -0.59 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)CNCCOc1ccc(cc1)Cl
  • InChi: 1S/C10H12ClNO3/c11-8-1-3-9(4-2-8)15-6-5-12-7-10(13)14/h1-4,12H,5-7H2,(H,13,14)
  • InChiKey: LVYZXRUNSGCILH-UHFFFAOYSA-N  

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 multilocularis titin 0.017 0.0892 0.0892
Echinococcus multilocularis transfer RNA-Phe 0.017 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.017 0.0892 0.1419
Brugia malayi Immunoglobulin I-set domain containing protein 0.0219 0.3131 0.415
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.017 0.0892 0.1419
Brugia malayi hypothetical protein 0.0288 0.6288 1
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0219 0.3131 0.3131
Onchocerca volvulus 0.017 0.0892 0.5
Echinococcus granulosus neuroglian 0.0219 0.3131 0.3131
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0219 0.3131 0.498
Schistosoma mansoni cell adhesion molecule 0.0219 0.3131 0.3672
Brugia malayi Immunoglobulin I-set domain containing protein 0.024 0.4088 0.5923
Loa Loa (eye worm) hypothetical protein 0.017 0.0892 0.1419
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0187 0.1658 0.2637
Loa Loa (eye worm) hypothetical protein 0.0219 0.3131 0.498
Echinococcus granulosus twitchin 0.0183 0.1473 0.1473
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0219 0.3131 0.3131
Schistosoma mansoni neuroglian 0.0219 0.3131 0.3672
Brugia malayi Immunoglobulin I-set domain containing protein 0.0288 0.6288 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0219 0.3131 0.415
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.017 0.0892 0.1419
Schistosoma mansoni titin 0.017 0.0892 0.1046
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.017 0.0892 0.0892
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.02 0.2239 0.2239
Loa Loa (eye worm) hypothetical protein 0.02 0.2239 0.3561
Loa Loa (eye worm) hypothetical protein 0.0288 0.6288 1
Schistosoma mansoni ephrin receptor 0.0178 0.1268 0.1487
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0219 0.3131 0.3672
Echinococcus granulosus roundabout 2 0.0219 0.3131 0.3131
Echinococcus granulosus roundabout 2 0.0219 0.3131 0.3131
Loa Loa (eye worm) TK/KIN16 protein kinase 0.024 0.4088 0.6502
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.017 0.0892 0.1419
Schistosoma mansoni hemicentin 0.017 0.0892 0.1046
Loa Loa (eye worm) hypothetical protein 0.0288 0.6288 1
Schistosoma mansoni myosin-binding protein-related 0.017 0.0892 0.1046
Schistosoma mansoni nephrin 0.0321 0.7761 0.9101
Onchocerca volvulus 0.017 0.0892 0.5
Loa Loa (eye worm) hypothetical protein 0.0288 0.6288 1
Schistosoma mansoni hypothetical protein 0.017 0.0892 0.1046
Schistosoma mansoni nephrin 0.0219 0.3131 0.3672
Loa Loa (eye worm) hypothetical protein 0.0232 0.3712 0.5904
Echinococcus multilocularis roundabout 2 0.0219 0.3131 0.3131
Echinococcus granulosus contactin 0.0219 0.3131 0.3131
Brugia malayi Immunoglobulin I-set domain containing protein 0.0219 0.3131 0.415
Loa Loa (eye worm) projectin 0.017 0.0892 0.1419
Loa Loa (eye worm) CAMK protein kinase 0.017 0.0892 0.1419
Echinococcus granulosus neuroglian 0.0183 0.1473 0.1473
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0219 0.3131 0.3131
Echinococcus multilocularis neuroglian 0.0219 0.3131 0.3131
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0219 0.3131 0.498
Schistosoma mansoni cell adhesion molecule 0.0219 0.3131 0.3672
Echinococcus multilocularis neuroglian 0.0183 0.1473 0.1473
Onchocerca volvulus 0.017 0.0892 0.5
Schistosoma mansoni cell adhesion molecule 0.017 0.0892 0.1046
Echinococcus multilocularis Down syndrome cell adhesion molecule 0.0187 0.1658 0.1658
Brugia malayi Immunoglobulin I-set domain containing protein 0.0187 0.1658 0.142
Schistosoma mansoni cell adhesion molecule 0.0338 0.8527 1
Schistosoma mansoni serine/threonine protein kinase 0.017 0.0892 0.1046
Echinococcus multilocularis roundabout 2 0.0219 0.3131 0.3131
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0178 0.1268 0.1268
Echinococcus multilocularis contactin neuroglian septate junction protein 0.0219 0.3131 0.3131
Loa Loa (eye worm) hypothetical protein 0.0232 0.3712 0.5904
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0178 0.1268 0.1268
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.017 0.0892 0.1419
Echinococcus granulosus titin 0.017 0.0892 0.0892
Echinococcus granulosus Down syndrome cell adhesion molecule 0.0187 0.1658 0.1658
Schistosoma mansoni titin 0.017 0.0892 0.1046
Schistosoma mansoni cell adhesion molecule 0.017 0.0892 0.1046
Echinococcus granulosus titin 0.017 0.0892 0.0892
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0219 0.3131 0.3131
Echinococcus granulosus nephrin 0.017 0.0892 0.0892
Brugia malayi Fibronectin type III domain containing protein 0.0288 0.6288 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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