Detailed information for compound 550876

Basic information

Technical information
  • TDR Targets ID: 550876
  • Name: 1-[(4-chlorophenoxy)methyl]-3,4-dihydroisoqui noline
  • MW: 271.741 | Formula: C16H14ClNO
  • H donors: 0 H acceptors: 0 LogP: 3.97 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)OCC1=NCCc2c1cccc2
  • InChi: 1S/C16H14ClNO/c17-13-5-7-14(8-6-13)19-11-16-15-4-2-1-3-12(15)9-10-18-16/h1-8H,9-11H2
  • InChiKey: YHDHSSBAHPSMPM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • famotine
  • 18429-78-2
  • Famotina [INN-Spanish]
  • Oprea1_513750
  • 1-(p-Chlorophenoxymethyl)-3,4-dihydroisoquinoline
  • AIDS349297
  • Isoquinoline, 1-[(4-chlorophenoxy)methyl]-3,4-dihydro-
  • Famotinum [INN-Latin]
  • Isoquinoline, 1-((4-chlorophenoxy)methyl)-3,4-dihydro-
  • AIDS-349297

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
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.002 0.3922 0.4866
Trypanosoma cruzi Fibronectin type III domain containing protein, putative 0.0013 0 0.5
Schistosoma mansoni serine/threonine protein kinase 0.0016 0.194 0.2407
Loa Loa (eye worm) hypothetical protein 0.0016 0.194 0.3192
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0018 0.2866 0.4715
Echinococcus multilocularis roundabout 2 0.002 0.3922 0.3922
Trypanosoma cruzi Fibronectin type III domain containing protein, putative 0.0013 0 0.5
Loa Loa (eye worm) projectin 0.0016 0.194 0.3192
Loa Loa (eye worm) hypothetical protein 0.0023 0.6078 1
Trypanosoma cruzi hypothetical protein, conserved 0.0013 0 0.5
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.002 0.3922 0.3922
Leishmania major hypothetical protein, conserved 0.0013 0 0.5
Schistosoma mansoni nephrin 0.0027 0.8018 0.9949
Brugia malayi Fibronectin type III domain containing protein 0.0023 0.6078 1
Echinococcus multilocularis Down syndrome cell adhesion molecule 0.0016 0.1982 0.1982
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0016 0.194 0.3192
Echinococcus granulosus titin 0.0016 0.194 0.194
Brugia malayi hypothetical protein 0.0023 0.6078 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.194 0.3192
Schistosoma mansoni ephrin receptor 0.0017 0.2163 0.2684
Echinococcus multilocularis roundabout 2 0.003 1 1
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0016 0.194 0.194
Echinococcus granulosus neuroglian 0.0014 0.0662 0.0662
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.194 0.3192
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0016 0.194 0.3192
Echinococcus multilocularis titin 0.0016 0.194 0.194
Schistosoma mansoni nephrin 0.002 0.3922 0.4866
Loa Loa (eye worm) hypothetical protein 0.0017 0.2643 0.4349
Echinococcus granulosus contactin 0.002 0.3922 0.3922
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.194 0.3192
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0017 0.2163 0.2163
Brugia malayi Immunoglobulin I-set domain containing protein 0.002 0.3922 0.6452
Schistosoma mansoni cell adhesion molecule 0.0016 0.194 0.2407
Echinococcus granulosus twitchin 0.0014 0.0662 0.0662
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0016 0.1982 0.326
Brugia malayi Immunoglobulin I-set domain containing protein 0.0023 0.6078 1
Onchocerca volvulus 0.0016 0.194 1
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.002 0.3922 0.3922
Echinococcus granulosus Down syndrome cell adhesion molecule 0.0016 0.1982 0.1982
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.002 0.3922 0.6452
Schistosoma mansoni cell adhesion molecule 0.002 0.3922 0.4866
Onchocerca volvulus 0.0016 0.194 1
Schistosoma mansoni titin 0.0016 0.194 0.2407
Schistosoma mansoni titin 0.0016 0.194 0.2407
Schistosoma mansoni neuroglian 0.002 0.3922 0.4866
Schistosoma mansoni cell adhesion molecule 0.002 0.3922 0.4866
Echinococcus multilocularis roundabout 2 0.002 0.3922 0.3922
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.194 0.3192
Schistosoma mansoni myosin-binding protein-related 0.0016 0.194 0.2407
Schistosoma mansoni cell adhesion molecule 0.0027 0.806 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0018 0.2866 0.4715
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.194 0.3192
Brugia malayi Immunoglobulin I-set domain containing protein 0.002 0.3922 0.6452
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.002 0.3922 0.3922
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.1982 0.326
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0016 0.194 0.3192
Echinococcus granulosus titin 0.0016 0.194 0.194
Loa Loa (eye worm) hypothetical protein 0.0017 0.2643 0.4349
Brugia malayi protein unc-22 0.0016 0.194 0.3192
Echinococcus multilocularis transfer RNA-Phe 0.0016 0.194 0.194
Echinococcus multilocularis neuroglian 0.002 0.3922 0.3922
Loa Loa (eye worm) hypothetical protein 0.0023 0.6078 1
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.002 0.3922 0.3922
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0014 0.0703 0.0703
Echinococcus granulosus roundabout 2 0.002 0.3922 0.3922
Loa Loa (eye worm) hypothetical protein 0.0014 0.0703 0.1156
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0017 0.2163 0.2163
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.194 0.3192
Loa Loa (eye worm) hypothetical protein 0.002 0.3922 0.6452
Echinococcus granulosus neuroglian 0.002 0.3922 0.3922
Echinococcus granulosus nephrin 0.0016 0.194 0.194
Loa Loa (eye worm) hypothetical protein 0.0016 0.194 0.3192
Loa Loa (eye worm) CAMK protein kinase 0.0016 0.194 0.3192
Schistosoma mansoni hypothetical protein 0.0016 0.194 0.2407
Echinococcus granulosus roundabout 2 0.002 0.3922 0.3922
Echinococcus multilocularis neuroglian 0.0014 0.0662 0.0662
Brugia malayi Immunoglobulin I-set domain containing protein 0.002 0.3922 0.6452
Schistosoma mansoni hemicentin 0.0016 0.194 0.2407
Schistosoma mansoni cell adhesion molecule 0.0016 0.194 0.2407
Echinococcus multilocularis contactin neuroglian septate junction protein 0.002 0.3922 0.3922
Onchocerca volvulus 0.0016 0.194 1
Trypanosoma brucei Fibronectin type III domain containing protein, putative 0.0013 0 0.5
Brugia malayi Immunoglobulin I-set domain containing protein 0.0016 0.194 0.3192
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.002 0.3922 0.6452
Loa Loa (eye worm) hypothetical protein 0.0023 0.6078 1
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0016 0.194 0.3192

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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