Detailed information for compound 1216138

Basic information

Technical information
  • TDR Targets ID: 1216138
  • Name: 1-(4-chlorobenzoyl)piperidine-4-carboxylic ac id
  • MW: 267.708 | Formula: C13H14ClNO3
  • H donors: 1 H acceptors: 3 LogP: 2.03 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1ccc(cc1)Cl)N1CCC(CC1)C(=O)O
  • InChi: 1S/C13H14ClNO3/c14-11-3-1-9(2-4-11)12(16)15-7-5-10(6-8-15)13(17)18/h1-4,10H,5-8H2,(H,17,18)
  • InChiKey: FGLQAKJRFPNIJT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[(4-chlorophenyl)-oxomethyl]-4-piperidinecarboxylic acid
  • 1-(4-chlorobenzoyl)isonipecotic acid
  • 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylic acid
  • 8X-0706
  • Oprea1_506771
  • SMR000154557
  • MLS000568435

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
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Toxoplasma gondii flagellar/basal body protein 0.0019 0.004 1
Trypanosoma brucei Carboxypeptidase-like protein 0.0019 0.004 1
Brugia malayi Zinc carboxypeptidase family protein 0.0019 0.004 1
Toxoplasma gondii zinc carboxypeptidase superfamily protein 0.0019 0.004 1
Echinococcus multilocularis cytosolic carboxypeptidase protein 5 0.0019 0.004 0.004
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Toxoplasma gondii zinc carboxypeptidase superfamily protein 0.0019 0.004 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0 0.5
Echinococcus granulosus Zinc carboxypeptidase family protein 0.0019 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0 0.5
Schistosoma mansoni subfamily M14A unassigned peptidase (M14 family) 0.011 1 1
Brugia malayi Carboxypeptidase A2 precursor 0.0019 0.004 1
Trypanosoma brucei metallo-peptidase, Clan MC, Family M14, putative 0.0019 0.004 1
Echinococcus granulosus cytosolic carboxypeptidase protein 5 0.0019 0.004 0.004
Schistosoma mansoni hypothetical protein 0.0019 0.004 0.004
Schistosoma mansoni peptidase 0.0019 0.004 0.004
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Giardia lamblia Nuclear ATP/GTP-binding protein 0.0019 0.004 1
Brugia malayi Zinc carboxypeptidase family protein 0.0019 0.004 1
Trypanosoma cruzi metallo-peptidase, Clan MC, Family M14, putative 0.0019 0.004 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Schistosoma mansoni metallocarboxypeptidase D peptidase unit 2 (M14 family) 0.0019 0.004 0.004
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Schistosoma mansoni peptidase 0.0019 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0 0.5
Giardia lamblia Nuclear ATP/GTP-binding protein 0.0019 0.004 1
Echinococcus multilocularis 0.0019 0.004 0.004
Brugia malayi Zinc carboxypeptidase family protein 0.0019 0.004 1
Leishmania major zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14 0.0019 0.004 1
Schistosoma mansoni peptidase 0.0019 0.004 0.004
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Onchocerca volvulus 0.011 1 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Brugia malayi Zinc carboxypeptidase family protein 0.0019 0.004 1
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0 0.5
Trypanosoma cruzi metallo-peptidase, Clan MC, Family M14, putative 0.0019 0.004 1
Echinococcus granulosus cytosolic carboxypeptidase 1 0.0019 0.004 0.004
Giardia lamblia Nuclear ATP/GTP-binding protein 0.0019 0.004 1
Brugia malayi Zinc carboxypeptidase family protein 0.0019 0.004 1
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0 0.5
Loa Loa (eye worm) zinc carboxypeptidase 0.0019 0.004 0.0051
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Leishmania major zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14 0.0019 0.004 1
Echinococcus multilocularis subfamily M14A unassigned peptidase 0.011 1 1
Echinococcus multilocularis Zinc carboxypeptidase family protein 0.0019 0.004 0.004
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Trypanosoma cruzi Carboxypeptidase-like protein 0.0019 0.004 1
Trypanosoma cruzi zinc carboxypeptidase, putative 0.0019 0.004 1
Leishmania major zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14 0.0019 0.004 1
Plasmodium vivax hypothetical protein, conserved 0.0019 0.004 1
Loa Loa (eye worm) zinc carboxypeptidase 0.0019 0.004 0.0051
Toxoplasma gondii zinc carboxypeptidase, putative 0.0019 0.004 1
Schistosoma mansoni protease m14 carboxypeptidase 0.0019 0.004 0.004
Onchocerca volvulus 0.011 1 1
Onchocerca volvulus 0.011 1 1
Loa Loa (eye worm) hypothetical protein 0.0091 0.7936 1
Trypanosoma brucei metallo-peptidase, Clan MC, Family M14, putative 0.0019 0.004 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Trichomonas vaginalis Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase 0.0019 0.004 1
Trypanosoma cruzi metallo-peptidase, Clan MC, Family M14 0.0019 0.004 1
Schistosoma mansoni family M14 non-peptidase homologue (M14 family) 0.0019 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Brugia malayi Zinc carboxypeptidase family protein 0.0019 0.004 1
Loa Loa (eye worm) zinc carboxypeptidase 0.0019 0.004 0.0051
Onchocerca volvulus 0.011 1 1
Brugia malayi Zinc carboxypeptidase family protein 0.0019 0.004 1
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Loa Loa (eye worm) hypothetical protein 0.0019 0.004 0.0051
Onchocerca volvulus Subfamily M14A unassigned peptidase homolog 0.011 1 1
Loa Loa (eye worm) zinc carboxypeptidase 0.0019 0.004 0.0051
Schistosoma mansoni carboxypeptidase N (M14 family) 0.0019 0.004 0.004
Brugia malayi Zinc carboxypeptidase family protein 0.0019 0.004 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 44.6684 um PUBCHEM_BIOASSAY: qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. (Class of assay: confirmatory) [Related pubchem assays: 596 ] ChEMBL. No reference

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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