Detailed information for compound 836767

Basic information

Technical information
  • TDR Targets ID: 836767
  • Name: N-(3-chlorophenyl)-2-[4-(4-methoxyphenyl)-2,2 -dimethyl-5-oxoimidazol-1-yl]acetamide
  • MW: 385.844 | Formula: C20H20ClN3O3
  • H donors: 1 H acceptors: 2 LogP: 3.14 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)C1=NC(N(C1=O)CC(=O)Nc1cccc(c1)Cl)(C)C
  • InChi: 1S/C20H20ClN3O3/c1-20(2)23-18(13-7-9-16(27-3)10-8-13)19(26)24(20)12-17(25)22-15-6-4-5-14(21)11-15/h4-11H,12H2,1-3H3,(H,22,25)
  • InChiKey: UDGIIPLTYANWSP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(3-chlorophenyl)-2-[4-(4-methoxyphenyl)-2,2-dimethyl-5-oxo-imidazol-1-yl]acetamide
  • N-(3-chlorophenyl)-2-[4-(4-methoxyphenyl)-2,2-dimethyl-5-oxo-1-imidazolyl]acetamide
  • N-(3-chlorophenyl)-2-[5-keto-4-(4-methoxyphenyl)-2,2-dimethyl-imidazol-1-yl]acetamide
  • N-(3-chlorophenyl)-2-[4-(4-methoxyphenyl)-2,2-dimethyl-5-oxo-imidazol-1-yl]ethanamide

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
Giardia lamblia 3-hydroxy-3-methylglutaryl-coenzyme A reductase 0.0063 0.0305 1
Loa Loa (eye worm) carboxylesterase 0.0201 0.3445 0.3445
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0134 0.1928 0.1878
Schistosoma mansoni hydroxymethylglutaryl-CoA reductase (NADPH) 0.0134 0.1928 0.1928
Loa Loa (eye worm) hypothetical protein 0.0134 0.1928 0.1928
Brugia malayi CHE-14 protein 0.0055 0.0129 0.0129
Schistosoma mansoni serine/threonine protein kinase 0.0052 0.0061 0.0061
Brugia malayi Carboxylesterase family protein 0.0201 0.3445 0.3445
Echinococcus granulosus hydroxymethylglutaryl coenzyme A reductase 0.0134 0.1928 0.1928
Echinococcus granulosus Niemann Pick C1 protein 0.0055 0.0129 0.0129
Trypanosoma brucei developmentally regulated phosphoprotein 0.0489 1 1
Schistosoma mansoni patched 1 0.0055 0.0129 0.0129
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0052 0.0061 0.0061
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0489 1 1
Echinococcus granulosus Protein patched homolog 1 0.0055 0.0129 0.0129
Onchocerca volvulus 0.005 0 0.5
Echinococcus multilocularis acetylcholinesterase 0.0201 0.3445 0.3445
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0055 0.0129 0.0129
Trypanosoma cruzi 3-hydroxy-3-methylglutaryl-CoA reductase 0.0134 0.1928 0.1878
Loa Loa (eye worm) hypothetical protein 0.0201 0.3445 0.3445
Echinococcus granulosus carboxylesterase 5A 0.0201 0.3445 0.3445
Echinococcus granulosus mitogen activated protein kinase 3 0.0052 0.0061 0.0061
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0198 0.338 1
Trichomonas vaginalis conserved hypothetical protein 0.0055 0.0129 0.278
Echinococcus multilocularis acetylcholinesterase 0.0201 0.3445 0.3445
Onchocerca volvulus Protein ultraspiracle homolog 0.005 0 0.5
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0063 0.0305 1
Trypanosoma cruzi developmentally regulated phosphoprotein, putative 0.0489 1 1
Echinococcus multilocularis mitogen activated protein kinase 3 0.0052 0.0061 0.0061
Loa Loa (eye worm) hypothetical protein 0.0055 0.0129 0.0129
Echinococcus granulosus acetylcholinesterase 0.0201 0.3445 0.3445
Echinococcus granulosus acetylcholinesterase 0.0201 0.3445 0.3445
Toxoplasma gondii pyruvate dehydrogenase kinase, putative 0.0171 0.2761 0.8134
Brugia malayi Carboxylesterase family protein 0.0201 0.3445 0.3445
Loa Loa (eye worm) hypothetical protein 0.0489 1 1
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0057 0.0161 0.0161
Schistosoma mansoni pyruvate dehydrogenase 0.0461 0.9381 0.9381
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0063 0.0305 1
Echinococcus multilocularis Niemann Pick C1 protein 0.0055 0.0129 0.0129
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0201 0.3445 0.3445
Echinococcus multilocularis protein patched 0.0055 0.0129 0.0129
Leishmania major pyruvate dehydrogenase (lipoamide) kinase, putative 0.0171 0.2761 0.2716
Schistosoma mansoni pyruvate dehydrogenase 0.0489 1 1
Brugia malayi MAP kinase sur-1 0.0052 0.0061 0.0061
Schistosoma mansoni lipoxygenase 0.0057 0.0161 0.0161
Echinococcus granulosus mitogen activated protein kinase 0.0052 0.0061 0.0061
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.005 0 0.5
Mycobacterium ulcerans hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase 0.0134 0.1928 0.5
Schistosoma mansoni pyruvate dehydrogenase 0.0461 0.9381 0.9381
Trypanosoma brucei 3-hydroxy-3-methylglutaryl-CoA reductase, putative 0.0134 0.1928 0.1878
Echinococcus granulosus sterol regulatory element binding protein 0.0055 0.0129 0.0129
Echinococcus multilocularis carboxylesterase 5A 0.0201 0.3445 0.3445
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0055 0.0129 0.0129
Echinococcus multilocularis protein dispatched 1 0.0055 0.0129 0.0129
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0057 0.0161 0.0161
Loa Loa (eye worm) hypothetical protein 0.0201 0.3445 0.3445
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0489 1 1
Leishmania major 3-hydroxy-3-methylglutaryl-CoA reductase 0.0134 0.1928 0.1878
Trypanosoma brucei pyruvate dehydrogenase (lipoamide) kinase, putative 0.0171 0.2761 0.2716
Onchocerca volvulus Bile acid receptor homolog 0.005 0 0.5
Echinococcus multilocularis hydroxymethylglutaryl coenzyme A reductase 0.0134 0.1928 0.1928
Echinococcus multilocularis mitogen activated protein kinase 0.0052 0.0061 0.0061
Trichomonas vaginalis 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative 0.0063 0.0305 1
Leishmania major developmentally regulated phosphoprotein-like protein 0.0489 1 1
Echinococcus granulosus Pyruvate dehydrogenase lipoamide kinase 0.0489 1 1
Loa Loa (eye worm) acetylcholinesterase 1 0.0201 0.3445 0.3445
Trypanosoma cruzi pyruvate dehydrogenase (lipoamide) kinase, putative 0.0171 0.2761 0.2716
Brugia malayi Hydroxymethylglutaryl-coenzyme A reductase family protein 0.0134 0.1928 0.1928
Echinococcus multilocularis sterol regulatory element binding protein 0.0055 0.0129 0.0129

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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