Detailed information for compound 956905

Basic information

Technical information
  • TDR Targets ID: 956905
  • Name: 1-[(4-bromophenyl)methyl]-3-(1-imidazol-1-yle thyl)-2-methylindole
  • MW: 394.308 | Formula: C21H20BrN3
  • H donors: 0 H acceptors: 1 LogP: 4.77 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc(cc1)Cn1c2ccccc2c(c1C)C(n1cncc1)C
  • InChi: 1S/C21H20BrN3/c1-15(24-12-11-23-14-24)21-16(2)25(20-6-4-3-5-19(20)21)13-17-7-9-18(22)10-8-17/h3-12,14-15H,13H2,1-2H3
  • InChiKey: DDZSWZZYZXUQHG-UHFFFAOYSA-N  

Network

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Synonyms

  • 1-[(4-bromophenyl)methyl]-3-(1-imidazol-1-ylethyl)-2-methyl-indole
  • 1-[(4-bromophenyl)methyl]-3-[1-(1-imidazolyl)ethyl]-2-methylindole
  • 1-(4-bromobenzyl)-3-(1-imidazol-1-ylethyl)-2-methyl-indole
  • 1H-Indole, 1-[(4-bromophenyl)methyl]-3-[1-(1H-imidazol-1-yl)ethyl]-2-methyl-
  • AIDS-165640
  • AIDS165640

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
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0109 0.0295 0.0295
Brugia malayi solute carrier family 12 member 1 0.0109 0.0295 0.0295
Mycobacterium tuberculosis Possible L-asparagine permease AnsP2 (L-asparagine transport protein) 0.0109 0.0295 0.5
Brugia malayi Amino acid permease family protein 0.0109 0.0295 0.0295
Loa Loa (eye worm) solute carrier family 12 member 1 0.0109 0.0295 0.0295
Trichomonas vaginalis amino acid permease, putative 0.0109 0.0295 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Loa Loa (eye worm) amino acid permease 0.0763 0.2617 0.2617
Loa Loa (eye worm) hypothetical protein 0.0654 0.2232 0.2232
Trichomonas vaginalis cation chloride cotransporter, putative 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0763 0.2617 0.2617
Mycobacterium ulcerans L-asparagine permease AnsP1 0.0109 0.0295 0.5
Schistosoma mansoni solute carrier family 12 electroneutral k-cl cotransporter 0.0763 0.2617 1
Onchocerca volvulus Solute carrier family 12 member 8 homolog 0.0109 0.0295 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0654 0.2232 0.2232
Trichomonas vaginalis lysine-specific permease, putative 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0763 0.2617 0.2617
Loa Loa (eye worm) hypothetical protein 0.0654 0.2232 0.2232
Trichomonas vaginalis gaba permease, putative 0.0109 0.0295 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Brugia malayi hypothetical protein 0.0109 0.0295 0.0295
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0763 0.2617 0.2617
Mycobacterium leprae POSSIBLE L-ASPARAGINE PERMEASE ANSP2 (L-ASPARAGINE TRANSPORT PROTEIN) 0.0109 0.0295 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Mycobacterium ulcerans GabA permease GabP 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0763 0.2617 0.2617
Onchocerca volvulus Solute carrier family 12 member 9 homolog 0.0109 0.0295 0.5
Mycobacterium ulcerans D-serine/D-alanine/glycine transporter, CycA 0.0109 0.0295 0.5
Echinococcus multilocularis solute carrier family 12 0.0763 0.2617 1
Loa Loa (eye worm) hypothetical protein 0.0763 0.2617 0.2617
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Mycobacterium tuberculosis Probable GABA permease GabP (4-amino butyrate transport carrier) (GAMA-aminobutyrate permease) 0.0109 0.0295 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0654 0.2232 0.2232
Brugia malayi Hypothetical 112.3 kDa protein K02A2.3 in chromosome II 0.0763 0.2617 0.2617
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Loa Loa (eye worm) angiotensin-converting enzyme family protein 0.2843 1 1
Loa Loa (eye worm) hypothetical protein 0.0654 0.2232 0.2232
Loa Loa (eye worm) hypothetical protein 0.0109 0.0295 0.0295
Mycobacterium tuberculosis Probable D-serine/alanine/glycine transporter protein CycA 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0654 0.2232 0.2232
Loa Loa (eye worm) hypothetical protein 0.0763 0.2617 0.2617
Mycobacterium leprae POSSIBLE L-ASPARAGINE PERMEASE ANSP1 (L-ASPARAGINE TRANSPORT PROTEIN) 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0763 0.2617 0.2617
Trichomonas vaginalis cation chloride cotransporter, putative 0.0109 0.0295 0.5
Loa Loa (eye worm) hypothetical protein 0.0654 0.2232 0.2232
Trichomonas vaginalis aromatic amino acid transporter, putative 0.0109 0.0295 0.5
Brugia malayi hypothetical protein 0.0109 0.0295 0.0295
Trichomonas vaginalis conserved hypothetical protein 0.0109 0.0295 0.5
Echinococcus granulosus solute carrier family 12 0.0763 0.2617 1
Loa Loa (eye worm) hypothetical protein 0.0109 0.0295 0.0295
Brugia malayi Amino acid permease family protein 0.0763 0.2617 0.2617

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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