Detailed information for compound 841160

Basic information

Technical information
  • TDR Targets ID: 841160
  • Name: [3-(3,4-dihydro-2H-quinoline-1-carbonyl)pheny l]-(3,4-dihydro-2H-quinolin-1-yl)methanone
  • MW: 396.481 | Formula: C26H24N2O2
  • H donors: 0 H acceptors: 2 LogP: 4.74 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N1CCCc2c1cccc2)c1cccc(c1)C(=O)N1CCCc2c1cccc2
  • InChi: 1S/C26H24N2O2/c29-25(27-16-6-12-19-8-1-3-14-23(19)27)21-10-5-11-22(18-21)26(30)28-17-7-13-20-9-2-4-15-24(20)28/h1-5,8-11,14-15,18H,6-7,12-13,16-17H2
  • InChiKey: RZXCAHVZPVUBDD-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 3,4-dihydro-2H-quinolin-1-yl-[3-(3,4-dihydro-2H-quinolin-1-yl-oxomethyl)phenyl]methanone
  • 3,4-dihydro-2H-quinolin-1-yl-[3-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)phenyl]methanone
  • 5344-45-6
  • BIM-0018452.P001
  • A1770/0074983
  • CBMicro_018421
  • ZINC00830014
  • BAS 00501652
  • Oprea1_096626
  • Oprea1_514133

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 twitchin 0.0128 0.6934 0.6934
Loa Loa (eye worm) TK protein kinase 0.0095 0.1943 0.1943
Echinococcus granulosus peroxidasin 0.0086 0.0596 0.0596
Loa Loa (eye worm) hypothetical protein 0.0086 0.0596 0.0596
Echinococcus granulosus tyrosine protein kinase transmembrane receptor 0.0095 0.1943 0.1943
Brugia malayi Immunoglobulin I-set domain containing protein 0.0095 0.1943 0.3529
Echinococcus multilocularis roundabout 2 0.0148 1 1
Schistosoma mansoni nephrin 0.0128 0.6934 1
Loa Loa (eye worm) hypothetical protein 0.0086 0.0596 0.0596
Loa Loa (eye worm) hypothetical protein 0.0086 0.0596 0.0596
Loa Loa (eye worm) hypothetical protein 0.0086 0.0596 0.0596
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0086 0.0596 0.0596
Schistosoma mansoni tyrosine kinase 0.0115 0.5009 0.7223
Echinococcus granulosus tyrosine protein kinase otk 0.0086 0.0596 0.0596
Schistosoma mansoni neuroglian 0.0086 0.0596 0.086
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0086 0.0596 0.0596
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.0086 0.0596 0.0596
Echinococcus granulosus hemicentin 1 0.0086 0.0596 0.0596
Echinococcus granulosus neuroglian 0.0086 0.0596 0.0596
Echinococcus granulosus contactin 0.0086 0.0596 0.0596
Schistosoma mansoni cell adhesion molecule 0.0086 0.0596 0.086
Loa Loa (eye worm) TK/ROR protein kinase 0.0095 0.1943 0.1943
Echinococcus multilocularis neuroglian 0.0128 0.6934 0.674
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0086 0.0596 0.086
Loa Loa (eye worm) hypothetical protein 0.0086 0.0596 0.0596
Echinococcus granulosus lachesin 0.0086 0.0596 0.0596
Schistosoma mansoni roundabout 0.0086 0.0596 0.086
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0086 0.0596 0.0596
Loa Loa (eye worm) hypothetical protein 0.0148 1 1
Loa Loa (eye worm) hypothetical protein 0.0086 0.0596 0.0596
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.0086 0.0596 0.0596
Echinococcus granulosus roundabout 2 0.0086 0.0596 0.0596
Loa Loa (eye worm) hypothetical protein 0.0148 1 1
Schistosoma mansoni septate junction protein 0.0086 0.0596 0.086
Loa Loa (eye worm) hypothetical protein 0.0086 0.0596 0.0596
Schistosoma mansoni titin 0.0086 0.0596 0.086
Brugia malayi Immunoglobulin I-set domain containing protein 0.0111 0.4412 1
Echinococcus granulosus roundabout 2 0.0086 0.0596 0.0596
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.0086 0.0596 0.086
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0111 0.4412 0.4412
Echinococcus granulosus neuroglian 0.0128 0.6934 0.6934
Echinococcus multilocularis tyrosine protein kinase transmembrane receptor 0.0095 0.1943 0.1432
Schistosoma mansoni cell adhesion molecule 0.0086 0.0596 0.086
Schistosoma mansoni nephrin 0.0086 0.0596 0.086
Onchocerca volvulus Tyrosine kinase homolog 0.0095 0.1943 1
Schistosoma mansoni septate junction protein 0.0086 0.0596 0.086
Loa Loa (eye worm) hypothetical protein 0.0086 0.0596 0.0596
Schistosoma mansoni cell adhesion molecule 0.0086 0.0596 0.086

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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