Detailed information for compound 766383

Basic information

Technical information
  • TDR Targets ID: 766383
  • Name: ethyl 2-amino-4-(3,4-dichlorophenyl)-7,7-dime thyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxyl ate
  • MW: 410.291 | Formula: C20H21Cl2NO4
  • H donors: 1 H acceptors: 2 LogP: 4.58 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)C1=C(N)OC2=C(C1c1ccc(c(c1)Cl)Cl)C(=O)CC(C2)(C)C
  • InChi: 1S/C20H21Cl2NO4/c1-4-26-19(25)17-15(10-5-6-11(21)12(22)7-10)16-13(24)8-20(2,3)9-14(16)27-18(17)23/h5-7,15H,4,8-9,23H2,1-3H3
  • InChiKey: UTOXLYZDXFZTAD-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 2-amino-4-(3,4-dichlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylic acid ethyl ester
  • 2-amino-4-(3,4-dichlorophenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carboxylic acid ethyl ester
  • CBMicro_016617
  • BIM-0016374.P001
  • ChemDiv1_010566

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 0.0123 1 1
Schistosoma mansoni thyroid hormone receptor 0.011 0.8057 0.8057
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.011 0.8057 0.8057
Brugia malayi Nuclear hormone receptor-like 1 0.011 0.8057 0.8057
Schistosoma mansoni RAR-like nuclear receptor 0.011 0.8057 0.8057
Echinococcus multilocularis FTZ F1 alpha 0.011 0.8057 0.8057
Echinococcus granulosus nuclear receptor 2DBD gamma 0.011 0.8057 0.8057
Brugia malayi nuclear hormone receptor 0.011 0.8057 0.8057
Onchocerca volvulus Dual oxidase homolog 0.0123 1 1
Loa Loa (eye worm) blistered cuticle protein 3 0.0123 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.011 0.8057 0.8057
Loa Loa (eye worm) animal heme peroxidase 0.0123 1 1
Brugia malayi Peroxidasin 0.0123 1 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.011 0.8057 0.8057
Onchocerca volvulus Peroxidasin homolog 0.0123 1 1
Onchocerca volvulus Peroxidasin homolog 0.0123 1 1
Onchocerca volvulus Chorion peroxidase homolog 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.011 0.8057 0.8057
Echinococcus granulosus FTZ F1 alpha 0.011 0.8057 0.8057
Echinococcus granulosus retinoic acid receptor rxr beta a 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.011 0.8057 0.8057
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Schistosoma mansoni peroxidasin 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.011 0.8057 0.8057
Onchocerca volvulus 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.011 0.8057 0.8057
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.011 0.8057 0.8057
Brugia malayi Nuclear hormone receptor family member nhr-40 0.011 0.8057 0.8057
Schistosoma mansoni peroxidasin 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.011 0.8057 0.8057
Brugia malayi Nuclear hormone receptor family member nhr-41 0.011 0.8057 0.8057
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.011 0.8057 0.8057
Brugia malayi Animal haem peroxidase family protein 0.0123 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.011 0.8057 0.8057
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.011 0.8057 0.8057
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.011 0.8057 0.8057
Brugia malayi Steroid receptor seven-up type 2 0.011 0.8057 0.8057
Brugia malayi nuclear receptor NHR-88 0.011 0.8057 0.8057
Brugia malayi Animal haem peroxidase family protein 0.0123 1 1
Brugia malayi Animal haem peroxidase family protein 0.0123 1 1
Loa Loa (eye worm) animal heme peroxidase 0.0123 1 1
Loa Loa (eye worm) steroid hormone receptor 0.011 0.8057 0.8057
Brugia malayi Blistered cuticle protein 3 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Echinococcus granulosus peroxidasin 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.011 0.8057 0.8057
Onchocerca volvulus 0.0123 1 1
Echinococcus multilocularis ecdysone induced protein 78C 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.011 0.8057 0.8057
Brugia malayi Nuclear hormone receptor family member nhr-19 0.011 0.8057 0.8057
Brugia malayi Nuclear hormone receptor family member nhr-31 0.011 0.8057 0.8057
Brugia malayi ecdysteroid receptor 0.011 0.8057 0.8057
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.011 0.8057 0.8057
Onchocerca volvulus 0.0123 1 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.011 0.8057 0.8057
Brugia malayi Nuclear hormone receptor family member nhr-14 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.011 0.8057 0.8057
Schistosoma mansoni Tr4/Tr2 (homologue) 0.011 0.8057 0.8057
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.011 0.8057 0.8057
Onchocerca volvulus Peroxidase homolog 0.0123 1 1
Brugia malayi steroid hormone receptor 0.011 0.8057 0.8057
Schistosoma mansoni coup transcription factor 0.011 0.8057 0.8057
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.011 0.8057 0.8057
Schistosoma mansoni retinoid-x-receptor (RXR) 0.011 0.8057 0.8057
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.011 0.8057 0.8057
Echinococcus granulosus ecdysone induced protein 78C 0.011 0.8057 0.8057
Brugia malayi Nuclear hormone receptor family member nhr-19 0.011 0.8057 0.8057
Schistosoma mansoni nuclear hormone receptor 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.011 0.8057 0.8057
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.011 0.8057 0.8057
Echinococcus multilocularis peroxidasin 0.0123 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.011 0.8057 0.8057
Brugia malayi Animal haem peroxidase family protein 0.0123 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.011 0.8057 0.8057
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.011 0.8057 0.8057
Brugia malayi photoreceptor-specific nuclear receptor 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.011 0.8057 0.8057
Loa Loa (eye worm) hypothetical protein 0.011 0.8057 0.8057
Loa Loa (eye worm) animal heme peroxidase 0.0123 1 1
Loa Loa (eye worm) hypothetical protein 0.0123 1 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.011 0.8057 0.8057
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.011 0.8057 0.8057
Loa Loa (eye worm) animal heme peroxidase 0.0123 1 1
Schistosoma mansoni retinoic acid receptor RXR 0.011 0.8057 0.8057
Brugia malayi Nuclear hormone receptor family member nhr-3 0.011 0.8057 0.8057
Brugia malayi Animal haem peroxidase family protein 0.0123 1 1
Schistosoma mansoni thyroid hormone receptor 0.011 0.8057 0.8057
Onchocerca volvulus Peroxidase homolog 0.0123 1 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.011 0.8057 0.8057
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.011 0.8057 0.8057

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.