Detailed information for compound 824571

Basic information

Technical information
  • TDR Targets ID: 824571
  • Name: 2-[3-[2-(1-cyclohexenyl)ethyl]-1-(4-fluorophe nyl)-2,5-dioxoimidazolidin-4-yl]-N-(4-methoxy phenyl)acetamide
  • MW: 465.517 | Formula: C26H28FN3O4
  • H donors: 1 H acceptors: 3 LogP: 3.84 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)NC(=O)CC1N(CCC2=CCCCC2)C(=O)N(C1=O)c1ccc(cc1)F
  • InChi: 1S/C26H28FN3O4/c1-34-22-13-9-20(10-14-22)28-24(31)17-23-25(32)30(21-11-7-19(27)8-12-21)26(33)29(23)16-15-18-5-3-2-4-6-18/h5,7-14,23H,2-4,6,15-17H2,1H3,(H,28,31)
  • InChiKey: JKIDBCMDGZODOH-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 2-[3-[2-(1-cyclohexenyl)ethyl]-1-(4-fluorophenyl)-2,5-dioxo-imidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide
  • 2-[3-[2-(1-cyclohexenyl)ethyl]-1-(4-fluorophenyl)-2,5-dioxo-4-imidazolidinyl]-N-(4-methoxyphenyl)acetamide
  • 2-[3-[2-(1-cyclohexenyl)ethyl]-1-(4-fluorophenyl)-2,5-diketo-imidazolidin-4-yl]-N-(4-methoxyphenyl)acetamide
  • 2-[3-[2-(1-cyclohexenyl)ethyl]-1-(4-fluorophenyl)-2,5-dioxo-imidazolidin-4-yl]-N-(4-methoxyphenyl)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
Toxoplasma gondii hypothetical protein 0.2523 0.5051 0.5
Loa Loa (eye worm) carbonic anhydrase 3 0.4884 1 1
Brugia malayi Putative carbonic anhydrase 5 precursor 0.4884 1 1
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.4884 1 0.5
Schistosoma mansoni carbonic anhydrase 0.2523 0.5051 0.5051
Brugia malayi Glycosyl hydrolases family 31 protein 0.1064 0.1992 0.1992
Trichomonas vaginalis glucosylceramidase, putative 0.3929 0.7998 1
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.4884 1 0.5
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.2523 0.5051 0.5051
Schistosoma mansoni bile acid beta-glucosidase-related 0.3167 0.64 0.64
Trichomonas vaginalis glucosylceramidase, putative 0.3929 0.7998 1
Brugia malayi Animal haem peroxidase family protein 0.0666 0.1157 0.1157
Trichomonas vaginalis glucosylceramidase, putative 0.2578 0.5166 0.6442
Brugia malayi Animal haem peroxidase family protein 0.0666 0.1157 0.1157
Schistosoma mansoni hypothetical protein 0.2523 0.5051 0.5051
Echinococcus granulosus carbonic anhydrase II 0.4884 1 1
Plasmodium falciparum carbonic anhydrase 0.2523 0.5051 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.2578 0.5166 0.6442
Loa Loa (eye worm) blistered cuticle protein 3 0.0666 0.1157 0.1157
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Echinococcus multilocularis bile acid beta glucosidase 0.3167 0.64 0.64
Echinococcus granulosus carbonic anhydrase 0.2523 0.5051 0.5051
Schistosoma mansoni alpha-glucosidase 0.1064 0.1992 0.1992
Echinococcus multilocularis carbonic anhydrase 0.2523 0.5051 0.5051
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Trichomonas vaginalis glucosylceramidase, putative 0.2578 0.5166 0.6442
Brugia malayi Peroxidasin 0.0666 0.1157 0.1157
Loa Loa (eye worm) ceramide glucosyltransferase 0.3629 0.7369 0.7369
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.4884 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.2578 0.5166 0.6442
Schistosoma mansoni ceramide glucosyltransferase 0.3629 0.7369 0.7369
Echinococcus granulosus peroxidasin 0.0666 0.1157 0.1157
Echinococcus granulosus lysosomal alpha glucosidase 0.1064 0.1992 0.1992
Brugia malayi hypothetical protein 0.0666 0.1157 0.1157
Loa Loa (eye worm) hypothetical protein 0.2523 0.5051 0.5051
Echinococcus granulosus bile acid beta glucosidase 0.3167 0.64 0.64
Leishmania major carbonic anhydrase-like protein 0.4884 1 0.5
Schistosoma mansoni peroxidasin 0.0666 0.1157 0.1157
Echinococcus multilocularis peroxidasin 0.0666 0.1157 0.1157
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.3929 0.7998 0.7998
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.4884 1 1
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Brugia malayi Ceramide glucosyltransferase 0.3629 0.7369 0.7369
Brugia malayi Blistered cuticle protein 3 0.0666 0.1157 0.1157
Trichomonas vaginalis glucosylceramidase, putative 0.3929 0.7998 1
Schistosoma mansoni carbonic anhydrase-related 0.2523 0.5051 0.5051
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.2523 0.5051 0.5051
Brugia malayi Animal haem peroxidase family protein 0.0666 0.1157 0.1157
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Trichomonas vaginalis glucosylceramidase, putative 0.2717 0.5457 0.6808
Echinococcus multilocularis carbonic anhydrase 0.2523 0.5051 0.5051
Schistosoma mansoni carbonic anhydrase-related 0.2523 0.5051 0.5051
Schistosoma mansoni alpha-glucosidase 0.1064 0.1992 0.1992
Echinococcus multilocularis carbonic anhydrase II 0.4884 1 1
Loa Loa (eye worm) animal heme peroxidase 0.0666 0.1157 0.1157
Giardia lamblia Ceramide glucosyltransferase 0.1645 0.321 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.3929 0.7998 1
Trichomonas vaginalis glucosylceramidase, putative 0.2578 0.5166 0.6442
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Echinococcus granulosus carbonic anhydrase 0.2523 0.5051 0.5051
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.2523 0.5051 0.5051
Echinococcus granulosus carbonic anhydrase 0.2523 0.5051 0.5051
Loa Loa (eye worm) hypothetical protein 0.2138 0.4242 0.4242
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.3929 0.7998 0.7998
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.2523 0.5051 0.5051
Schistosoma mansoni peroxidasin 0.0666 0.1157 0.1157
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.2523 0.5051 0.5051
Trypanosoma brucei carbonic anhydrase-like protein 0.4884 1 0.5
Echinococcus multilocularis lysosomal alpha glucosidase 0.1064 0.1992 0.1992
Echinococcus granulosus ceramide glucosyltransferase 0.3629 0.7369 0.7369
Onchocerca volvulus Glucosylceramidase homolog 0.2578 0.5166 0.6453
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.4884 1 1
Echinococcus multilocularis carbonic anhydrase 0.2523 0.5051 0.5051
Trichomonas vaginalis glucosylceramidase, putative 0.2578 0.5166 0.6442
Echinococcus multilocularis ceramide glucosyltransferase 0.3629 0.7369 0.7369
Echinococcus multilocularis non lysosomal glucosylceramidase 0.3167 0.64 0.64
Schistosoma mansoni ceramide glucosyltransferase 0.3629 0.7369 0.7369
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Loa Loa (eye worm) hypothetical protein 0.2523 0.5051 0.5051
Loa Loa (eye worm) animal heme peroxidase 0.0666 0.1157 0.1157
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.1064 0.1992 0.1992
Trichomonas vaginalis glucosylceramidase, putative 0.2578 0.5166 0.6442
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Echinococcus granulosus non lysosomal glucosylceramidase 0.3167 0.64 0.64
Onchocerca volvulus 0.0715 0.126 0.0166
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.2523 0.5051 0.5051
Schistosoma mansoni carbonic anhydrase-related 0.2523 0.5051 0.5051
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Loa Loa (eye worm) animal heme peroxidase 0.0666 0.1157 0.1157
Schistosoma mansoni bile acid beta-glucosidase-related 0.3167 0.64 0.64
Echinococcus multilocularis lysosomal alpha glucosidase 0.1064 0.1992 0.1992
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Brugia malayi Animal haem peroxidase family protein 0.0666 0.1157 0.1157
Onchocerca volvulus Ceramide glucosyltransferase homolog 0.3629 0.7369 1
Trichomonas vaginalis glucosylceramidase, putative 0.3929 0.7998 1
Loa Loa (eye worm) animal heme peroxidase 0.0666 0.1157 0.1157
Trichomonas vaginalis glucosylceramidase, putative 0.3929 0.7998 1
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Brugia malayi Animal haem peroxidase family protein 0.0666 0.1157 0.1157
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Loa Loa (eye worm) hypothetical protein 0.0666 0.1157 0.1157
Loa Loa (eye worm) hypothetical protein 0.2523 0.5051 0.5051
Trichomonas vaginalis glucosylceramidase, putative 0.2717 0.5457 0.6808

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.