Detailed information for compound 646322

Basic information

Technical information
  • TDR Targets ID: 646322
  • Name: 2-(2-chloro-4,6-dimethylphenoxy)-N-phenylacet amide
  • MW: 289.757 | Formula: C16H16ClNO2
  • H donors: 1 H acceptors: 1 LogP: 4.15 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccccc1)COc1c(C)cc(cc1Cl)C
  • InChi: 1S/C16H16ClNO2/c1-11-8-12(2)16(14(17)9-11)20-10-15(19)18-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,18,19)
  • InChiKey: YYBSFHBSCSYSHG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(2-Chloro-4,6-dimethyl-phenoxy)-N-phenyl-acetamide
  • 2-(2-chloro-4,6-dimethyl-phenoxy)-N-phenyl-ethanamide
  • STK012580
  • Oprea1_057171
  • ZINC00373644
  • BAS 02242428
  • Oprea1_603189

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
Brugia malayi hypothetical protein 0.0148 0.0634 0.2334
Brugia malayi hypothetical protein 0.0025 0.0039 0.0142
Leishmania major DNA polymerase kappa, putative 0.0038 0.0104 0.0381
Echinococcus multilocularis microtubule associated protein 2 0.2081 1 1
Entamoeba histolytica hypothetical protein 0.0039 0.0109 0.0402
Trypanosoma brucei Eukaryotic translation initiation factor 4E-2 0.0069 0.0252 0.0798
Echinococcus granulosus geminin 0.0185 0.0815 0.0815
Brugia malayi Pre-SET motif family protein 0.0208 0.0927 0.3412
Trypanosoma cruzi eukaryotic translation initiation factor 4E (eIF4E) interacting protein, putative 0.0069 0.0252 0.0929
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.0121 0.0444
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0039 0.0142
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0042 0.0121 0.0444
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.014 0.0598 0.2201
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Trypanosoma cruzi Eukaryotic translation initiation factor 4E type 5, putative 0.0069 0.0252 0.0929
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0038 0.0104 0.0381
Trichomonas vaginalis conserved hypothetical protein 0.0069 0.0252 0.0929
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0069 0.0252 0.0929
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0069 0.0252 0.0929
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.0039 0.0142
Trichomonas vaginalis set domain proteins, putative 0.0237 0.1066 0.3925
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0063 0.0063
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-1 0.0578 0.2717 1
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0063 0.0063
Toxoplasma gondii hypothetical protein 0.0048 0.015 0.0553
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Leishmania major hypothetical protein, conserved 0.0069 0.0252 0.0929
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.0207 0.1817
Leishmania major hypothetical protein, conserved 0.0025 0.0039 0.0142
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0063 0.0234
Entamoeba histolytica hypothetical protein 0.0039 0.0109 0.0402
Trypanosoma brucei unspecified product 0.0038 0.0104 0.0243
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0039 0.1531
Schistosoma mansoni hypothetical protein 0.0185 0.0815 0.0815
Leishmania major eukaryotic translation initiation factor-like 0.0578 0.2717 1
Toxoplasma gondii eukaryotic initiation factor-4E, putative 0.0578 0.2717 1
Brugia malayi hypothetical protein 0.0039 0.0109 0.0402
Plasmodium falciparum eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0795 0.3772 0.3772
Schistosoma mansoni terminal deoxycytidyl transferase 0.0038 0.0104 0.0104
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.014 0.0598 0.2201
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.0109 0.0109
Leishmania major DNA polymerase eta, putative 0.0063 0.0225 0.0827
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0104 0.0243
Brugia malayi Pre-SET motif family protein 0.003 0.0063 0.0234
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-4 0.0069 0.0252 0.0929
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Trypanosoma cruzi DNA polymerase kappa, putative 0.0038 0.0104 0.0381
Trypanosoma brucei Eukaryotic translation initiation factor 4E-4 0.0069 0.0252 0.0798
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0058 0.0201 0.074
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Brugia malayi ImpB/MucB/SamB family protein 0.0038 0.0104 0.0381
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0038 0.0104 0.0381
Leishmania major eukaryotic translation initiation factor eIF-4E, putative 0.0578 0.2717 1
Echinococcus multilocularis geminin 0.0185 0.0815 0.0815
Toxoplasma gondii hypothetical protein 0.0069 0.0252 0.0929
Trypanosoma cruzi Eukaryotic translation initiation factor 4E type 5, putative 0.0069 0.0252 0.0929
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Trypanosoma cruzi cysteine peptidase, putative 0.0064 0.0228 0.0839
Trypanosoma cruzi DNA polymerase kappa, putative 0.0038 0.0104 0.0381
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Schistosoma mansoni hypothetical protein 0.0185 0.0815 0.0815
Trypanosoma cruzi DNA polymerase kappa, putative 0.0038 0.0104 0.0381
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.0109 0.0109
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0038 0.0104 0.0104
Loa Loa (eye worm) translation initiation factor 4E 0.0578 0.2717 1
Trypanosoma cruzi eukaryotic translation initiation factor 4E (eIF4E) interacting protein, putative 0.0069 0.0252 0.0929
Onchocerca volvulus 0.003 0.0063 0.0595
Giardia lamblia Hypothetical protein 0.0069 0.0252 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0039 0.0142
Trypanosoma brucei unspecified product 0.0026 0.0046 0.0028
Echinococcus granulosus eukaryotic translation initiation factor 4E 0.0578 0.2717 0.2717
Toxoplasma gondii eukaryotic initiation factor-4E, putative 0.0069 0.0252 0.0929
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.014 0.0598 0.2089
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.0207 0.0763
Loa Loa (eye worm) hypothetical protein 0.003 0.0063 0.0234
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Entamoeba histolytica hypothetical protein 0.0069 0.0252 0.0929
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0037 0.0097 0.0358
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-1 0.0578 0.2717 1
Trypanosoma cruzi cysteine peptidase, putative 0.0064 0.0228 0.0839
Entamoeba histolytica hypothetical protein 0.0069 0.0252 0.0929
Brugia malayi Eukaryotic translation initiation factor 4E type 3, putative 0.0069 0.0252 0.0929
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Trypanosoma cruzi cysteine peptidase, putative 0.0064 0.0228 0.0839
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0207 0.0207
Trypanosoma brucei Eukaryotic translation initiation factor 4E-3 0.0069 0.0252 0.0798
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0208 0.0927 0.3412
Entamoeba histolytica translation initiation factor 4e, putative 0.0069 0.0252 0.0929
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0069 0.0252 0.0929
Onchocerca volvulus 0.0148 0.0634 0.5946
Trypanosoma brucei DNA polymerase kappa, putative 0.0026 0.0046 0.0028
Mycobacterium tuberculosis Conserved hypothetical protein 0.0156 0.0675 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0063 0.0063
Plasmodium vivax SET domain protein, putative 0.003 0.0063 0.2515
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Echinococcus granulosus dna polymerase kappa 0.0038 0.0104 0.0104
Entamoeba histolytica hypothetical protein 0.0039 0.0109 0.0402
Trypanosoma brucei Eukaryotic translation initiation factor 4E-1 0.0578 0.2717 1
Schistosoma mansoni DNA polymerase eta 0.0063 0.0225 0.0225
Schistosoma mansoni hypothetical protein 0.0039 0.0109 0.0109
Trichomonas vaginalis conserved hypothetical protein 0.0069 0.0252 0.0929
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0578 0.2717 1
Giardia lamblia Translation elongation factor 0.0069 0.0252 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0063 0.0063
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0038 0.0104 0.0381
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0069 0.0252 0.0929
Leishmania major cathepsin L-like protease 0.0064 0.0228 0.0839
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0578 0.2717 1
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.0039 0.1531
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Entamoeba histolytica deoxycytidyl transferase, putative 0.0038 0.0104 0.0381
Plasmodium falciparum eukaryotic translation initiation factor 4E 0.0069 0.0252 1
Leishmania major eukaryotic translation initiation factor-like protein 0.0578 0.2717 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0296 0.1354 0.4983
Trypanosoma brucei DNA polymerase eta, putative 0.0063 0.0225 0.0694
Echinococcus multilocularis dna polymerase kappa 0.0038 0.0104 0.0104
Trichomonas vaginalis eukaryotic translation initiation factor 4E type, putative 0.0069 0.0252 0.0929
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Trypanosoma cruzi DNA polymerase eta, putative 0.0037 0.0097 0.0358
Leishmania major cathepsin L-like protease 0.0064 0.0228 0.0839
Mycobacterium ulcerans hypothetical protein 0.0156 0.0675 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.0039 0.0142
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0578 0.2717 1
Giardia lamblia Hypothetical protein 0.0069 0.0252 1
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0104 0.0243
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0207 0.1817
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0038 0.0104 0.0104
Trypanosoma brucei DNA polymerase kappa, putative 0.0026 0.0046 0.0028
Echinococcus multilocularis eukaryotic translation initiation factor 4E 0.0578 0.2717 0.2717
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0296 0.1354 0.4911
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.0207 0.0207
Onchocerca volvulus Putative eukaryotic translation initiation factor 4e 0.0069 0.0252 0.2367
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0207 0.0207
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0207 0.1817
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0578 0.2717 1
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-3 0.0069 0.0252 0.0929
Leishmania major hypothetical protein, conserved 0.0069 0.0252 0.0929
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0038 0.0104 0.0104
Trypanosoma brucei DNA polymerase IV, putative 0.0038 0.0104 0.0243
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0051 0.0165 0.0607
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0042 0.0121 0.0306
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Schistosoma mansoni microtubule-associated protein tau 0.2081 1 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0063 0.0063
Leishmania major mitochondrial DNA polymerase beta 0.0296 0.1354 0.4983
Trichomonas vaginalis DNA polymerase eta, putative 0.0038 0.0104 0.0381
Leishmania major eukaryotic translation initiation factor 4e, putative 0.0069 0.0252 0.0929
Trypanosoma cruzi DNA polymerase kappa, putative 0.0038 0.0104 0.0381
Echinococcus granulosus dna polymerase eta 0.0063 0.0225 0.0225
Brugia malayi eukaryotic translation initiation factor 4E-1 0.0069 0.0252 0.0929
Entamoeba histolytica eukaryotic translation initiation factor 4E, putative 0.0578 0.2717 1
Trypanosoma brucei unspecified product 0.0026 0.0046 0.0028
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0578 0.2717 1
Trichomonas vaginalis hypothetical protein 0.0069 0.0252 0.0929
Echinococcus granulosus eukaryotic translation initiation factor 4E type 0.0069 0.0252 0.0252
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Leishmania major eukaryotic translation initiation factor, putative 0.0069 0.0252 0.0929
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0063 0.0063
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.0207 0.0207
Trichomonas vaginalis conserved hypothetical protein 0.0069 0.0252 0.0929
Leishmania major cathepsin L-like protease 0.0064 0.0228 0.0839
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Brugia malayi ImpB/MucB/SamB family protein 0.0063 0.0225 0.0827
Trichomonas vaginalis eukaryotic translation initiation factor 4E, putative 0.0069 0.0252 0.0929
Trypanosoma cruzi DNA polymerase eta, putative 0.0063 0.0225 0.0827
Echinococcus multilocularis dna polymerase eta 0.0063 0.0225 0.0225
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0042 0.0121 0.0444
Trypanosoma brucei DNA polymerase kappa, putative 0.0038 0.0104 0.0243
Trypanosoma cruzi major cysteine proteinase, putative 0.005 0.0162 0.0595
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Plasmodium vivax hypothetical protein, conserved 0.0069 0.0252 1
Loa Loa (eye worm) hypothetical protein 0.0063 0.0225 0.0827
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0207 0.1817
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0063 0.0063
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.0207 0.0763
Entamoeba histolytica eukaryotic initiation factor 4E, putative 0.0069 0.0252 0.0929
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.0109 0.0109
Trypanosoma brucei DNA polymerase kappa, putative 0.0026 0.0046 0.0028
Loa Loa (eye worm) hypothetical protein 0.0148 0.0634 0.2334
Leishmania major DNA polymerase eta, putative 0.0037 0.0097 0.0358
Plasmodium vivax translation initiation factor 4E, putative 0.0069 0.0252 1
Trypanosoma brucei Eukaryotic translation initiation factor 4E type 5 0.0069 0.0252 0.0798
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.0039 0.1531
Trypanosoma cruzi Eukaryotic translation initiation factor 4E-4 0.0069 0.0252 0.0929
Schistosoma mansoni eukaryotic translation initiation factor 4e 0.0578 0.2717 0.2717
Entamoeba histolytica eukaryotic initiation factor 4E, putative 0.0069 0.0252 0.0929
Giardia lamblia hypothetical protein 0.0069 0.0252 1
Loa Loa (eye worm) eukaryotic translation initiation factor 4E type 3 0.0069 0.0252 0.0929
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0058 0.0058
Entamoeba histolytica hypothetical protein 0.0039 0.0109 0.0402
Brugia malayi translation initiation factor 4E 0.0578 0.2717 1
Loa Loa (eye worm) eukaryotic translation initiation factor 4E-1 0.0069 0.0252 0.0929
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0064 0.0228 0.0707
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0296 0.1354 0.4983
Onchocerca volvulus 0.0237 0.1066 1
Trypanosoma cruzi cruzipain precursor, putative 0.0064 0.0228 0.0839

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.