Detailed information for compound 880268

Basic information

Technical information
  • TDR Targets ID: 880268
  • Name: [2-[(4-chlorophenyl)amino]-2-oxoethyl] 2-meth oxybenzoate
  • MW: 319.74 | Formula: C16H14ClNO4
  • H donors: 1 H acceptors: 2 LogP: 3.28 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1C(=O)OCC(=O)Nc1ccc(cc1)Cl
  • InChi: 1S/C16H14ClNO4/c1-21-14-5-3-2-4-13(14)16(20)22-10-15(19)18-12-8-6-11(17)7-9-12/h2-9H,10H2,1H3,(H,18,19)
  • InChiKey: WOXNBPHGDHNHFD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • [2-[(4-chlorophenyl)amino]-2-oxo-ethyl] 2-methoxybenzoate
  • 2-methoxybenzoic acid [2-[(4-chlorophenyl)amino]-2-oxoethyl] ester
  • 2-methoxybenzoic acid [2-[(4-chlorophenyl)amino]-2-keto-ethyl] ester
  • ST5196735
  • ZINC00131830
  • Oprea1_269248

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 geranylgeranyl transferase beta subunit 0.3142 0.8909 0.8548
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.3518 1 1
Trichomonas vaginalis protein farnesyltransferase beta subunit, putative 0.1025 0.2766 0.2727
Trichomonas vaginalis geranylgeranyl transferase type beta subunit, putative 0.2758 0.7796 0.7784
Echinococcus multilocularis geranylgeranyl transferase type I beta subunit 0.3142 0.8909 0.8904
Entamoeba histolytica protein farnesyltransferase alpha subunit, putative 0.3518 1 1
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.1025 0.2766 0.0526
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.3518 1 1
Loa Loa (eye worm) hypothetical protein 0.1025 0.2766 0.2727
Loa Loa (eye worm) hypothetical protein 0.3518 1 1
Echinococcus granulosus protein prenyltransferase alpha subunit 0.0928 0.2487 0.2447
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.0131 0.0174 0.0121
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.2758 0.7796 0.7784
Giardia lamblia Rab geranylgeranyltransferase 0.1025 0.2766 0.0372
Loa Loa (eye worm) prenyltransferase alpha subunit repeat containing protein 0.0928 0.2487 0.2447
Echinococcus multilocularis geranylgeranyl transferase type 2 subunit alpha 0.0928 0.2487 0.2447
Mycobacterium tuberculosis Halimadienyl diphosphate synthase 0.1074 0.2908 0.5
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0131 0.0174 0.0121
Echinococcus granulosus protein farnesyltransferase subunit beta 0.2758 0.7796 0.7784
Trypanosoma cruzi protein farnesyltransferase, putative 0.2758 0.7796 1
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.3518 1 1
Echinococcus granulosus voltage gated potassium channel 0.0131 0.0174 0.0121
Plasmodium vivax prenyltransferase alpha subunit, putative 0.3518 1 1
Toxoplasma gondii prenyltransferase and squalene oxidase repeat-containing protein 0.2758 0.7796 1
Trypanosoma cruzi lanosterol synthase, putative 0.1074 0.2908 0.0794
Schistosoma mansoni voltage-gated potassium channel 0.0131 0.0174 0.0174
Plasmodium falciparum geranylgeranyl transferase type2 beta subunit, putative 0.1025 0.2766 0.0372
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.2758 0.7796 0.7784
Entamoeba histolytica protein farnesyltransferase beta subunit, putative 0.2758 0.7796 0.7067
Echinococcus granulosus protein farnesyltransferase alpha subunit 0.3518 1 1
Loa Loa (eye worm) hypothetical protein 0.0131 0.0174 0.0121
Schistosoma mansoni geranylgeranyl transferase type I beta subunit 0.3142 0.8909 0.8909
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0453 0.1107 0.106
Trypanosoma brucei protein farnesyltransferase beta subunit 0.2758 0.7796 1
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.3142 0.8909 0.8904
Echinococcus multilocularis voltage gated potassium channel 0.0131 0.0174 0.0121
Onchocerca volvulus 0.0928 0.2487 0.5
Trichomonas vaginalis protein farnesyltransferase beta subunit, putative 0.1025 0.2766 0.2727
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0453 0.1107 0.106
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0453 0.1107 0.106
Loa Loa (eye worm) prenyltransferase and squalene oxidase repeat family protein 0.2758 0.7796 0.7784
Trypanosoma cruzi hypothetical protein, conserved 0.1025 0.2766 0.0526
Loa Loa (eye worm) hypothetical protein 0.1025 0.2766 0.2727
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0928 0.2487 0.2487
Schistosoma mansoni protein farnesyltransferase alpha subunit 0.3518 1 1
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.2758 0.7796 0.7784
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.009 0.0053 0.0053
Echinococcus multilocularis Rab geranylgeranyltransferase, beta subunit 0.1025 0.2766 0.2727
Brugia malayi Prenyltransferase and squalene oxidase repeat family protein 0.3142 0.8909 0.8904
Plasmodium falciparum geranylgeranyltransferase, putative 0.1025 0.2766 0.0372
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.009 0.0053 0.0053
Schistosoma mansoni geranylgeranyl transferase type I beta subunit 0.3142 0.8909 0.8909
Plasmodium vivax geranylgeranyl transferase type2 beta subunit, putative 0.1025 0.2766 0.0372
Toxoplasma gondii hypothetical protein 0.2589 0.7306 0.9077
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.009 0.0053 0.0053
Trypanosoma cruzi geranylgeranyl transferase type II beta subunit, putative 0.1025 0.2766 0.0526
Toxoplasma gondii Rab geranylgeranyl transferase type II beta subunit, putative 0.1025 0.2766 0.0526
Brugia malayi Probable protein farnesyltransferase beta subunit, putative 0.1025 0.2766 0.2727
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0423 0.1021 0.0973
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.3518 1 1
Giardia lamblia Rab geranylgeranyltransferase 0.3518 1 1
Schistosoma mansoni protein farnesyltransferase subunit beta 0.2758 0.7796 0.7796
Trypanosoma cruzi hypothetical protein, conserved 0.1025 0.2766 0.0526
Echinococcus multilocularis protein farnesyltransferase subunit beta 0.2758 0.7796 0.7784
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.2758 0.7796 0.7784
Schistosoma mansoni voltage-gated potassium channel 0.0495 0.1228 0.1228
Trichomonas vaginalis protein farnesyltransferase alpha subunit/RAB geranylgeranyl transferase alpha subunit, putative 0.2589 0.7306 0.7292
Trichomonas vaginalis type I geranylgeranyltransferase beta subunit, putative 0.2758 0.7796 0.7784
Schistosoma mansoni geranylgeranyl transferase type II beta subunit 0.1025 0.2766 0.2766
Loa Loa (eye worm) hypothetical protein 0.0393 0.0934 0.0886
Trypanosoma brucei geranylgeranyl transferase type II beta subunit, putative 0.1025 0.2766 0.0526
Trypanosoma cruzi protein farnesyltransferase, putative 0.2758 0.7796 1
Entamoeba histolytica Rab geranylgeranyltransferase beta subunit, putative 0.1025 0.2766 0.0372
Trichomonas vaginalis geranylgeranyl transferase type I beta subunit, putative 0.3142 0.8909 0.8904
Trypanosoma brucei lanosterol synthase 0.1074 0.2908 0.0794
Brugia malayi Protein prenyltransferase alpha subunit repeat containing protein 0.0928 0.2487 0.2447
Trypanosoma cruzi lanosterol synthase, putative 0.1074 0.2908 0.0794
Trichomonas vaginalis geranylgeranyl transferase type II beta subunit, putative 0.2758 0.7796 0.7784
Plasmodium falciparum protein farnesyltransferase subunit alpha 0.3518 1 1
Echinococcus multilocularis protein prenyltransferase alpha subunit 0.0928 0.2487 0.2447
Plasmodium vivax conserved Plasmodium protein, unknown function 0.1734 0.4823 0.311
Echinococcus granulosus geranylgeranyl transferase type 2 subunit alpha 0.0928 0.2487 0.2447
Leishmania major geranylgeranyltransferase, putative 0.1025 0.2766 0.0526
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.009 0.0053 0.0053
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0423 0.1021 0.0973
Giardia lamblia Prenyltransferase 0.2758 0.7796 0.7067
Schistosoma mansoni voltage-gated potassium channel 0.0131 0.0174 0.0174
Echinococcus multilocularis protein farnesyltransferase alpha subunit 0.3518 1 1
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0131 0.0174 0.0121
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0453 0.1107 0.106
Plasmodium vivax geranylgeranyltransferase, putative 0.1025 0.2766 0.0372
Leishmania major farnesyltransferase beta subunit 0.2758 0.7796 1
Plasmodium falciparum protein farnesyltransferase subunit beta 0.2758 0.7796 0.7067
Trichomonas vaginalis protein farnesyltransferase alpha subunit, putative 0.0928 0.2487 0.2447
Schistosoma mansoni voltage-gated potassium channel 0.0495 0.1228 0.1228
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.009 0.0053 0.0053
Plasmodium vivax farnesyltransferase beta subunit, putative 0.2758 0.7796 0.7067
Echinococcus granulosus geranylgeranyl transferase type I beta subunit 0.3142 0.8909 0.8904
Schistosoma mansoni voltage-gated potassium channel 0.009 0.0053 0.0053

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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