Detailed information for compound 1464266

Basic information

Technical information
  • TDR Targets ID: 1464266
  • Name: 1-cyclohexyl-4-[1-[1-[(4-fluorophenyl)methyl] tetrazol-5-yl]propyl]piperazine
  • MW: 386.509 | Formula: C21H31FN6
  • H donors: 0 H acceptors: 3 LogP: 3.68 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC(c1nnnn1Cc1ccc(cc1)F)N1CCN(CC1)C1CCCCC1
  • InChi: 1S/C21H31FN6/c1-2-20(27-14-12-26(13-15-27)19-6-4-3-5-7-19)21-23-24-25-28(21)16-17-8-10-18(22)11-9-17/h8-11,19-20H,2-7,12-16H2,1H3
  • InChiKey: SYXLOOHCNOJAFE-UHFFFAOYSA-N  

Network

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Synonyms

  • 1-cyclohexyl-4-[1-[1-[(4-fluorophenyl)methyl]-5-tetrazolyl]propyl]piperazine
  • 1-cyclohexyl-4-[1-[1-(4-fluorobenzyl)tetrazol-5-yl]propyl]piperazine
  • 1-cyclohexyl-4-[1-[1-[(4-fluorophenyl)methyl]-1,2,3,4-tetrazol-5-yl]propyl]piperazine
  • ASN 05555956

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 family S12 unassigned peptidase (S12 family) 0.0043 0.0135 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0135 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0043 0.0135 0.0057
Brugia malayi beta-lactamase family protein 0.0043 0.0135 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0043 0.0135 1
Brugia malayi beta-lactamase family protein 0.0043 0.0135 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0278 0.1354 0.1235
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0043 0.0135 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0043 0.0135 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0135 1
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0135 0.5
Loa Loa (eye worm) hypothetical protein 0.0033 0.0079 0.5808
Onchocerca volvulus 0.0043 0.0135 1
Loa Loa (eye worm) beta-lactamase 0.0043 0.0135 1
Brugia malayi intermediate filament protein 0.0033 0.0079 0.5808
Leishmania major hypothetical protein, conserved 0.0043 0.0135 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0043 0.0135 0.5
Mycobacterium ulcerans thymidine phosphorylase 0.194 1 1
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0135 0.5
Echinococcus multilocularis thymidine phosphorylase 0.194 1 1
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0079 0.5808
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0135 0.5
Toxoplasma gondii ABC1 family protein 0.0043 0.0135 0.5
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0079 0.5808
Loa Loa (eye worm) hypothetical protein 0.0032 0.0076 0.5579
Trichomonas vaginalis esterase, putative 0.0043 0.0135 0.5
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0135 0.5
Brugia malayi beta-lactamase 0.0043 0.0135 1
Mycobacterium tuberculosis Probable anthranilate phosphoribosyltransferase TrpD 0.0548 0.2758 0.2658
Trichomonas vaginalis penicillin-binding protein, putative 0.0043 0.0135 0.5
Loa Loa (eye worm) hypothetical protein 0.0043 0.0135 1
Plasmodium vivax hypothetical protein, conserved 0.0043 0.0135 0.5
Onchocerca volvulus 0.0043 0.0135 1
Trichomonas vaginalis D-aminoacylase, putative 0.0043 0.0135 0.5
Loa Loa (eye worm) hypothetical protein 0.0043 0.0135 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0135 1
Onchocerca volvulus 0.0043 0.0135 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0043 0.0135 0.0057
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0079 0.5808
Trypanosoma cruzi hypothetical protein, conserved 0.0043 0.0135 0.5
Loa Loa (eye worm) hypothetical protein 0.0043 0.0135 1
Mycobacterium tuberculosis Probable thymidine phosphorylase DeoA (tdrpase) (pyrimidine phosphorylase) 0.194 1 1
Mycobacterium ulcerans anthranilate phosphoribosyltransferase 0.0548 0.2758 0.2658
Mycobacterium leprae Probable anthranilate phosphoribosyltransferase TrpD 0.0548 0.2758 1

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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