Detailed information for compound 944011

Basic information

Technical information
  • TDR Targets ID: 944011
  • Name: 2-bromo-1-benzofuran
  • MW: 197.029 | Formula: C8H5BrO
  • H donors: 0 H acceptors: 0 LogP: 3.35 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1cc2c(o1)cccc2
  • InChi: 1S/C8H5BrO/c9-8-5-6-3-1-2-4-7(6)10-8/h1-5H
  • InChiKey: RNEOFIVNTNLSEH-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-bromobenzofuran
  • CC 06610
  • ZINC00158632

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 cysteine protease, putative 0.0701 1 1
Leishmania major cysteine peptidase A (CPA) 0.0701 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0467 0.4415 0.4415
Plasmodium vivax vivapain-2 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0369 0.2092 0.2092
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Echinococcus granulosus cathepsin l cysteine peptidase 0.0701 1 1
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0369 0.2092 0.2092
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Onchocerca volvulus 0.0701 1 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0701 1 1
Echinococcus granulosus cathepsin L cysteine protease 0.0369 0.2092 0.2092
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Brugia malayi Cathepsin L-like precursor 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Leishmania major cathepsin L-like protease 0.0701 1 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Echinococcus multilocularis cysteine protease 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Echinococcus granulosus cathepsin l1 0.0467 0.4415 0.4415
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Loa Loa (eye worm) hypothetical protein 0.0467 0.4415 0.4415
Entamoeba histolytica cysteine proteinase, putative 0.0467 0.4415 0.2937
Trypanosoma cruzi cruzipain precursor, putative 0.0701 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0369 0.2092 0.2092
Brugia malayi Cathepsin L-like precursor 0.0467 0.4415 0.4415
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.0701 1 1
Loa Loa (eye worm) hypothetical protein 0.0467 0.4415 0.4415
Leishmania major cathepsin L-like protease 0.0701 1 0.5
Brugia malayi Papain family cysteine protease containing protein 0.0701 1 1
Brugia malayi Papain family cysteine protease containing protein 0.0369 0.2092 0.2092
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Brugia malayi Cathepsin L-like precursor 0.0701 1 1
Echinococcus granulosus cathepsin l1 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Onchocerca volvulus 0.0701 1 1
Brugia malayi Cathepsin L-like precursor 0.0701 1 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0369 0.2092 0.2092
Brugia malayi Cathepsin L-like precursor 0.0701 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0701 1 1
Echinococcus granulosus cysteine protease 0.0369 0.2092 0.2092
Leishmania major cathepsin L-like protease 0.0701 1 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Onchocerca volvulus Cathepsin F homolog 0.0701 1 1
Entamoeba histolytica cysteine proteinase, putative 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0467 0.4415 0.2937
Echinococcus granulosus cathepsin L 0.0369 0.2092 0.2092
Plasmodium vivax vivapain-2 0.0701 1 1
Echinococcus multilocularis cysteine protease 0.0701 1 1
Loa Loa (eye worm) hypothetical protein 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0701 1 1
Brugia malayi Cathepsin L-like precursor 0.0701 1 1
Trypanosoma cruzi cysteine protease, putative 0.0369 0.2092 0.2092
Leishmania major cathepsin L-like protease 0.0701 1 0.5
Schistosoma mansoni cathepsin F (C01 family) 0.0701 1 1
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0467 0.4415 0.4415
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Brugia malayi Cathepsin L-like precursor 0.0467 0.4415 0.4415
Toxoplasma gondii cathepsin CPL 0.0701 1 0.5
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.0467 0.4415 0.4415
Trypanosoma cruzi cysteine proteinase, putative 0.0369 0.2092 0.2092
Onchocerca volvulus 0.0701 1 1
Loa Loa (eye worm) cysteine protease 0.0701 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0701 1 1
Loa Loa (eye worm) ctsf protein 0.0701 1 1
Brugia malayi Papain family cysteine protease containing protein 0.0369 0.2092 0.2092
Leishmania major cathepsin L-like protease 0.0701 1 0.5
Onchocerca volvulus Cathepsin L homolog 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Onchocerca volvulus 0.0701 1 1
Brugia malayi cathepsin L-like precursor 0.0467 0.4415 0.4415
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Entamoeba histolytica cysteine proteinase, putative 0.0701 1 1
Leishmania major cathepsin L-like protease 0.0701 1 0.5
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Onchocerca volvulus Cathepsin L homolog 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0369 0.2092 0.2092
Onchocerca volvulus 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Trypanosoma cruzi cysteine proteinase, putative 0.0369 0.2092 0.2092
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0701 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0701 1 1
Onchocerca volvulus 0.0701 1 1
Brugia malayi Cathepsin L-like cysteine proteinase 0.0467 0.4415 0.4415
Echinococcus multilocularis cathepsin L 0.0369 0.2092 0.2092
Plasmodium falciparum cysteine proteinase falcipain 3 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0701 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0467 0.4415 0.2937
Onchocerca volvulus 0.0701 1 1
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0701 1 1
Leishmania major cathepsin L-like protease 0.0701 1 0.5
Trypanosoma cruzi cysteine peptidase, putative 0.0701 1 1
Leishmania major cathepsin L-like protease 0.0701 1 0.5
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0701 1 1
Loa Loa (eye worm) fibroinase 0.0701 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0701 1 1
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0701 1 1
Echinococcus granulosus cathepsin L cysteine proteinase 0.0701 1 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0701 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 140 uM Inhibition of human CYP2A6 in baculovirus-infected insect cell system using coumarin 7 as substrate preincubated for 10 mins by fluorescence assay ChEMBL. 25458499

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

1 literature reference was collected for this gene.

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