Detailed information for compound 835398

Basic information

Technical information
  • TDR Targets ID: 835398
  • Name: (2-bromophenyl)-(3,4-dihydro-1H-isoquinolin-2 -yl)methanone
  • MW: 316.192 | Formula: C16H14BrNO
  • H donors: 0 H acceptors: 1 LogP: 3.6 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccccc1C(=O)N1CCc2c(C1)cccc2
  • InChi: 1S/C16H14BrNO/c17-15-8-4-3-7-14(15)16(19)18-10-9-12-5-1-2-6-13(12)11-18/h1-8H,9-11H2
  • InChiKey: DBXPROSECMKCBQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • BIM-0018799.P001
  • ZINC00215086
  • CBMicro_018594
  • Oprea1_076473
  • Oprea1_857286
  • (2-Bromo-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)-methanone
  • BAS 00500935
  • AK-968/36929081
  • 2-(2-Bromobenzoyl)-1,2,3,4-tetrahydroisoquinoline
  • STK074061

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
Entamoeba histolytica tyrosin kinase, putative 0.0046 0.0441 0.947
Trichomonas vaginalis CMGC family protein kinase 0.0047 0.0466 1
Echinococcus multilocularis tyrosine protein kinase Fgr 0.0024 0.0067 0.0143
Echinococcus granulosus plexin a4 0.0196 0.2964 0.2964
Brugia malayi cell division control protein 2 homolog 0.0047 0.0466 0.0997
Echinococcus granulosus epidermal growth factor receptor 0.0143 0.2066 0.2066
Entamoeba histolytica hypothetical protein 0.003 0.018 0.3868
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0044 0.0406 0.0869
Trypanosoma brucei cdc2-related kinase 3 0.0047 0.0466 0.5
Schistosoma mansoni plexin 0.0166 0.2455 0.5257
Entamoeba histolytica cell division protein kinase 2, putative 0.0047 0.0466 1
Plasmodium vivax protein kinase Crk2 0.0047 0.0466 0.5
Schistosoma mansoni cell adhesion molecule 0.0047 0.0461 0.0987
Loa Loa (eye worm) hypothetical protein 0.003 0.018 0.0386
Brugia malayi IPT/TIG domain containing protein 0.003 0.018 0.0386
Echinococcus granulosus MAP kinase activated protein kinase 2 0.0196 0.2963 0.2963
Echinococcus multilocularis semaphorin 5B 0.0069 0.0834 0.1786
Schistosoma mansoni fibrocystin l 0.003 0.018 0.0386
Loa Loa (eye worm) hypothetical protein 0.0069 0.0834 0.1786
Echinococcus multilocularis cyclin dependent kinase 5 0.0047 0.0466 0.0997
Schistosoma mansoni plexin 0.0097 0.1291 0.2765
Echinococcus multilocularis epidermal growth factor receptor 0.0143 0.2066 0.4424
Brugia malayi map kinase activated protein kinase protein 2 0.0196 0.2963 0.6346
Schistosoma mansoni semaphorin 5-related 0.0069 0.0834 0.1786
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0047 0.0466 0.5
Entamoeba histolytica hypothetical protein 0.003 0.018 0.3868
Onchocerca volvulus 0.0069 0.0834 0.3346
Loa Loa (eye worm) hypothetical protein 0.0044 0.0406 0.0869
Loa Loa (eye worm) hypothetical protein 0.0044 0.0406 0.0869
Echinococcus granulosus epidermal growth factor receptor 0.0143 0.2066 0.2066
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0024 0.0067 0.0067
Trichomonas vaginalis CMGC family protein kinase 0.0047 0.0466 1
Echinococcus multilocularis hypothetical protein 0.0069 0.0834 0.1786
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0047 0.0466 0.0466
Loa Loa (eye worm) camk/mapkapk/mapkapk protein kinase 0.0196 0.2963 0.6346
Trypanosoma cruzi cdc2-related kinase 3 0.0047 0.0466 0.5
Brugia malayi Fibronectin type III domain containing protein 0.0044 0.0406 0.0869
Entamoeba histolytica hypothetical protein 0.003 0.018 0.3868
Schistosoma mansoni hypothetical protein 0.003 0.018 0.0386
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0024 0.0067 0.0143
Schistosoma mansoni hypothetical protein 0.003 0.018 0.0386
Schistosoma mansoni nephrin 0.0046 0.0449 0.0962
Entamoeba histolytica protein kinase domain containing protein 0.0046 0.0441 0.947
Schistosoma mansoni serine/threonine protein kinase 0.0047 0.0466 0.0997
Brugia malayi Immunoglobulin I-set domain containing protein 0.0044 0.0406 0.0869
Echinococcus granulosus insulin receptor 0.0298 0.467 0.467
Echinococcus multilocularis transcription factor collier 0.003 0.018 0.0386
Loa Loa (eye worm) hypothetical protein 0.0069 0.0834 0.1786
Loa Loa (eye worm) plexin A 0.0196 0.2964 0.6348
Loa Loa (eye worm) hypothetical protein 0.003 0.018 0.0386
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0213 0.3239 0.6937
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0047 0.0466 0.5
Entamoeba histolytica hypothetical protein 0.003 0.018 0.3868
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0047 0.0466 0.0997
Trypanosoma cruzi cdc2-related kinase 3 0.0047 0.0466 0.5
Schistosoma mansoni hypothetical protein 0.0097 0.1291 0.2765
Loa Loa (eye worm) hypothetical protein 0.0044 0.0406 0.0869
Schistosoma mansoni tyrosine kinase 0.0024 0.0067 0.0143
Onchocerca volvulus Tyrosine kinase homolog 0.0168 0.2492 1
Echinococcus multilocularis roundabout 2 0.005 0.0504 0.108
Schistosoma mansoni tyrosine kinase 0.0127 0.1805 0.3865
Loa Loa (eye worm) hypothetical protein 0.0047 0.0461 0.0987
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0024 0.0067 0.0143
Echinococcus granulosus Immunoglobulin 0.0044 0.0406 0.0406
Echinococcus granulosus tyrosine protein kinase Src42A 0.0024 0.0067 0.0067
Echinococcus granulosus defective proboscis extension response 0.0044 0.0406 0.0406
Loa Loa (eye worm) sema domain-containing protein 0.0069 0.0834 0.1786
Echinococcus granulosus tyrosine protein kinase Fyn 0.0024 0.0067 0.0067
Echinococcus multilocularis Immunoglobulin 0.0044 0.0406 0.0869
Echinococcus granulosus tyrosine protein kinase Fyn 0.0024 0.0067 0.0067
Brugia malayi Probable exocyst complex component Sec5 0.003 0.018 0.0386
Echinococcus multilocularis cyclin dependent kinase 1 0.0047 0.0466 0.0997
Onchocerca volvulus 0.0166 0.2455 0.9851
Loa Loa (eye worm) hypothetical protein 0.005 0.0504 0.108
Echinococcus multilocularis tyrosine protein kinase Src64B 0.0024 0.0067 0.0143
Brugia malayi hypothetical protein 0.0069 0.0834 0.1786
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0044 0.0406 0.0869
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0024 0.0067 0.0143
Loa Loa (eye worm) hypothetical protein 0.0069 0.0834 0.1786
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0024 0.0067 0.0143
Brugia malayi Tyrosine-protein kinase abl-1 0.0024 0.0067 0.0143
Loa Loa (eye worm) hypothetical protein 0.0155 0.2274 0.4871
Schistosoma mansoni tyrosine kinase 0.0021 0.003 0.0064
Loa Loa (eye worm) hypothetical protein 0.0069 0.0834 0.1786
Echinococcus multilocularis epidermal growth factor receptor 0.0143 0.2066 0.4424
Echinococcus multilocularis exocyst complex component 2 0.003 0.018 0.0386
Loa Loa (eye worm) hypothetical protein 0.005 0.0504 0.108
Echinococcus multilocularis MAP kinase activated protein kinase 2 0.0196 0.2963 0.6346
Echinococcus multilocularis Immunoglobulin 0.0044 0.0406 0.0869
Echinococcus granulosus semaphorin 5B 0.0069 0.0834 0.0834
Schistosoma mansoni tyrosine kinase 0.0143 0.2066 0.4424
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0047 0.0466 0.0997
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0047 0.0466 0.5
Onchocerca volvulus 0.015 0.2188 0.8779
Loa Loa (eye worm) hypothetical protein 0.0044 0.0406 0.0869
Brugia malayi Protein kinase domain containing protein 0.0047 0.0466 0.0997
Brugia malayi hypothetical protein 0.0044 0.0406 0.0869
Echinococcus granulosus semaphorin 1A 0.0069 0.0834 0.0834
Entamoeba histolytica cell division protein kinase 2, putative 0.0047 0.0466 1
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0047 0.0466 0.0997
Loa Loa (eye worm) TK/INSR protein kinase 0.0298 0.467 1
Schistosoma mansoni tyrosine kinase 0.0143 0.2066 0.4424
Brugia malayi Sema domain containing protein 0.0069 0.0834 0.1786
Echinococcus granulosus c src tyrosine kinase 0.0024 0.0067 0.0067
Brugia malayi Sema domain containing protein 0.0069 0.0834 0.1786
Schistosoma mansoni hypothetical protein 0.0069 0.0834 0.1786
Echinococcus granulosus insulin growth factor 1 receptor beta 0.0298 0.467 0.467
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.0024 0.0067 0.0067
Echinococcus granulosus transcription factor collier 0.003 0.018 0.018
Echinococcus granulosus cyclin dependent kinase 1 0.0047 0.0466 0.0466
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.0024 0.0067 0.0143
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0143 0.2066 0.2066
Brugia malayi Immunoglobulin I-set domain containing protein 0.0213 0.3239 0.6937
Brugia malayi Protein kinase domain containing protein 0.0171 0.2535 0.5429
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0047 0.0461 0.0461
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0024 0.0067 0.0143
Loa Loa (eye worm) sema domain-containing protein 0.0069 0.0834 0.1786
Loa Loa (eye worm) hypothetical protein 0.0069 0.0834 0.1786
Schistosoma mansoni serine/threonine protein kinase 0.0196 0.2963 0.6346
Schistosoma mansoni vesicular amine transporter 0.0044 0.0406 0.0869
Echinococcus multilocularis tyrosine protein kinase Abl 0.0024 0.0067 0.0143
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0044 0.0406 0.0869
Echinococcus multilocularis cyclin dependent kinase 1 0.0047 0.0466 0.0997
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.0024 0.0067 0.0143
Loa Loa (eye worm) hypothetical protein 0.0166 0.2455 0.5257
Trypanosoma brucei cdc2-related kinase 1 0.0047 0.0466 0.5
Loa Loa (eye worm) hypothetical protein 0.0044 0.0406 0.0869
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0024 0.0067 0.0143
Brugia malayi DNA-binding protein LAG-1 0.003 0.018 0.0386
Echinococcus multilocularis c src tyrosine kinase 0.0024 0.0067 0.0143
Echinococcus granulosus exocyst complex component 2 0.003 0.018 0.018
Schistosoma mansoni tyrosine kinase 0.0298 0.467 1
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.0024 0.0067 0.0143
Loa Loa (eye worm) TK/EGFR protein kinase 0.0143 0.2066 0.4424
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.0024 0.0067 0.0067
Giardia lamblia Kinase, CMGC CDK 0.0047 0.0466 0.5
Echinococcus granulosus tyrosine protein kinase Fyn 0.0024 0.0067 0.0067
Brugia malayi Plexin repeat family protein 0.0166 0.2455 0.5257
Echinococcus multilocularis cyclin dependent kinase 0.0047 0.0466 0.0997
Brugia malayi hypothetical protein 0.0069 0.0834 0.1786
Schistosoma mansoni tyrosine kinase 0.0143 0.2066 0.4424
Brugia malayi plexin A 0.0196 0.2964 0.6348
Schistosoma mansoni tyrosine kinase 0.0024 0.0067 0.0143
Schistosoma mansoni hypothetical protein 0.0069 0.0834 0.1786
Echinococcus granulosus cyclin dependent kinase 5 0.0047 0.0466 0.0466
Schistosoma mansoni tyrosine kinase 0.0127 0.1805 0.3865
Brugia malayi Furin-like cysteine rich region family protein 0.0143 0.2066 0.4424
Plasmodium falciparum protein kinase 5 0.0047 0.0466 0.5
Loa Loa (eye worm) hypothetical protein 0.003 0.018 0.0386
Giardia lamblia Kinase, CMGC CDK 0.0047 0.0466 0.5
Echinococcus multilocularis 0.0037 0.0295 0.0631
Echinococcus multilocularis plexin a4 0.0196 0.2964 0.6348
Loa Loa (eye worm) hypothetical protein 0.0044 0.0406 0.0869
Schistosoma mansoni tyrosine kinase 0.0024 0.0067 0.0143
Echinococcus multilocularis neuroglian 0.0046 0.0449 0.0962
Schistosoma mansoni tyrosine kinase 0.0298 0.467 1
Echinococcus multilocularis insulin receptor 0.0298 0.467 1
Echinococcus granulosus roundabout 2 0.005 0.0504 0.0504
Loa Loa (eye worm) SRC-1 0.0024 0.0067 0.0143
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0298 0.467 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.0449 0.0961
Entamoeba histolytica cell surface protease gp63, putative 0.003 0.018 0.3868
Loa Loa (eye worm) hypothetical protein 0.0069 0.0834 0.1786
Echinococcus granulosus twitchin 0.0047 0.0466 0.0466
Brugia malayi Protein kinase domain containing protein 0.0298 0.467 1
Schistosoma mansoni serine/threonine protein kinase 0.0047 0.0466 0.0997
Trypanosoma cruzi cdc2-related kinase 1 0.0047 0.0466 0.5
Echinococcus granulosus cyclin dependent kinase 0.0047 0.0466 0.0466
Schistosoma mansoni tyrosine kinase 0.0127 0.1805 0.3865
Loa Loa (eye worm) hypothetical protein 0.0097 0.1291 0.2765
Trichomonas vaginalis CMGC family protein kinase 0.0047 0.0466 1
Loa Loa (eye worm) hypothetical protein 0.003 0.018 0.0386
Echinococcus granulosus tyrosine protein kinase Src64B 0.0024 0.0067 0.0067
Brugia malayi SRC-1 0.0024 0.0067 0.0143
Echinococcus granulosus neuroglian 0.0046 0.0449 0.0449
Schistosoma mansoni tyrosine kinase 0.0024 0.0067 0.0143
Echinococcus granulosus tyrosine protein kinase Lyn 0.0025 0.0084 0.0084
Trypanosoma cruzi cdc2-related kinase 1 0.0047 0.0466 0.5

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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