Detailed information for compound 1803003

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 267.54 | Formula: C9H9Cl3N2O
  • H donors: 1 H acceptors: 0 LogP: 4.53 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCO/N=C/Nc1cc(Cl)c(c(c1)Cl)Cl
  • InChi: 1S/C9H9Cl3N2O/c1-2-15-14-5-13-6-3-7(10)9(12)8(11)4-6/h3-5H,2H2,1H3,(H,13,14)
  • InChiKey: IVHKFKWFOPGACD-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

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 Cytochrome P450 family protein 0.0013 0.1302 0.1302
Loa Loa (eye worm) hypothetical protein 0.0011 0.0892 0.0892
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0054 0.853 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0.0892 0.0892
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0.0892 0.0892
Schistosoma mansoni phosphatidylserine receptor 0.0017 0.1934 0.1934
Brugia malayi Steroid receptor seven-up type 2 0.0011 0.0892 0.0892
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0.0892 0.0892
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0.0892 0.0892
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0.0892 0.0892
Echinococcus granulosus ATP binding cassette sub family G 0.0011 0.0953 0.0953
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0.0892 0.0892
Brugia malayi jmjC domain containing protein 0.0017 0.1934 0.1934
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0013 0.1302 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0013 0.1302 0.1302
Schistosoma mansoni hypothetical protein 0.0009 0.0634 0.0634
Echinococcus granulosus FTZ F1 alpha 0.0011 0.0892 0.0892
Loa Loa (eye worm) jmjC domain-containing protein 0.0017 0.1934 0.1934
Loa Loa (eye worm) hypothetical protein 0.0017 0.1934 0.1934
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0892 0.0892
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0.0892 0.0892
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.853 0.5
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0.0892 0.0892
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0.0892 0.0892
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0892 0.0892
Echinococcus multilocularis JmjC domain containing protein 4 0.0017 0.1934 0.1934
Schistosoma mansoni ATP-binding cassette sub-family g2 (white protein) (abcg2) 0.0011 0.0953 0.0953
Entamoeba histolytica ABC transporter, putative 0.0011 0.0953 0.5
Brugia malayi nuclear receptor NHR-88 0.0011 0.0892 0.0892
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0062 1 1
Brugia malayi steroid hormone receptor 0.0011 0.0892 0.0892
Schistosoma mansoni phd/f-box containing protein 0.0017 0.1934 0.1934
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0054 0.853 1
Giardia lamblia Kinase, CMGC MAPK 0.0054 0.853 1
Brugia malayi ABC transporter family protein 0.0009 0.0656 0.0656
Trypanosoma brucei protein kinase, putative 0.0054 0.853 1
Echinococcus multilocularis mitogen activated protein kinase 0.0054 0.853 0.853
Echinococcus granulosus mitogen activated protein kinase 3 0.0054 0.853 0.853
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0892 0.0892
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0.0892 0.5
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0054 0.853 0.853
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0.0892 0.0892
Echinococcus multilocularis lysine specific demethylase 6a 0.0017 0.1934 0.1934
Brugia malayi jmjC domain containing protein 0.0017 0.1934 0.1934
Schistosoma mansoni jumonji/arid domain-containing protein 0.0062 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0892 0.0892
Brugia malayi Cytochrome P450 family protein 0.0013 0.1302 0.1302
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0892 0.0892
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0.0892 0.0892
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0.0892 0.0892
Schistosoma mansoni nuclear hormone receptor 0.0011 0.0892 0.0892
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0892 0.0892
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0017 0.1934 0.1934
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0.0892 0.0892
Schistosoma mansoni jumonji domain containing protein 0.0062 1 1
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0054 0.853 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.1934 0.1934
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0.0892 0.0892
Echinococcus granulosus JmjC domain containing protein 4 0.0017 0.1934 0.1934
Plasmodium falciparum JmjC domain-containing protein, putative 0.0017 0.1934 1
Schistosoma mansoni serine/threonine protein kinase 0.0054 0.853 0.853
Loa Loa (eye worm) hypothetical protein 0.0011 0.0892 0.0892
Brugia malayi jmjC domain containing protein 0.0017 0.1934 0.1934
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.0011 0.0892 0.0892
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0.0892 0.0892
Leishmania major hypothetical protein, conserved 0.0017 0.1934 0.1295
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0.0892 0.0892
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0.0892 0.0892
Schistosoma mansoni thyroid hormone receptor 0.0011 0.0892 0.0892
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0.0892 0.0892
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0054 0.853 1
Echinococcus granulosus jumonji domain containing 1A 0.0017 0.1934 0.1934
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.853 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.0011 0.0892 0.0892
Echinococcus multilocularis phd:f box containing protein 0.0017 0.1934 0.1934
Trypanosoma brucei cytochrome P450, putative 0.0013 0.1302 0.046
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0062 1 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0.0892 0.0892
Loa Loa (eye worm) CYP4Cod1 0.0013 0.1302 0.1302
Loa Loa (eye worm) ABC transporter 0.0009 0.0656 0.0656
Loa Loa (eye worm) cytochrome P450 family protein 0.0013 0.1302 0.1302
Plasmodium vivax JmjC domain containing protein 0.0017 0.1934 1
Echinococcus multilocularis FTZ F1 alpha 0.0011 0.0892 0.0892
Loa Loa (eye worm) steroid hormone receptor 0.0011 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.0011 0.0892 0.0892
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0017 0.1934 0.1934
Trypanosoma cruzi cytochrome P450, putative 0.0013 0.1302 0.046
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.0011 0.0892 0.0892
Echinococcus multilocularis mitogen activated protein kinase 3 0.0054 0.853 0.853
Echinococcus granulosus lysine specific demethylase 5A 0.0062 1 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0017 0.1934 0.1934
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.0009 0.064 0.064
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0.0892 0.0892
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0054 0.853 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0.0892 0.0892
Brugia malayi jmjC domain containing protein 0.0062 1 1
Toxoplasma gondii histone lysine demethylase JMJD6a 0.0017 0.1934 0.1295
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0.0892 0.0892
Echinococcus multilocularis ATP binding cassette sub family G 0.0011 0.0953 0.0953
Brugia malayi nuclear hormone receptor 0.0011 0.0892 0.0892
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0.0892 0.5
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0.0892 0.0892
Echinococcus granulosus ATP binding cassette sub family G 0.0011 0.0953 0.0953
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0.0892 0.0892
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0.0892 0.0892
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0.0892 0.0892
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0017 0.1934 0.1295
Loa Loa (eye worm) hypothetical protein 0.0011 0.0892 0.0892
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0.0892 0.0892
Echinococcus granulosus phd:f box containing protein 0.0017 0.1934 0.1934
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0.0892 0.0892
Echinococcus granulosus lysine specific demethylase 6a 0.0017 0.1934 0.1934
Echinococcus multilocularis ATP binding cassette sub family G 0.0011 0.0953 0.0953
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.0011 0.0892 0.0892
Schistosoma mansoni coup transcription factor 0.0011 0.0892 0.0892
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0017 0.1934 0.1295
Brugia malayi jmjC domain containing protein 0.0017 0.1934 0.1934
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0017 0.1934 0.1934
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.853 0.5
Echinococcus multilocularis lysine specific demethylase 5A 0.0062 1 1
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0017 0.1934 0.1295
Loa Loa (eye worm) jmjC domain-containing protein 0.0062 1 1
Echinococcus multilocularis ATP binding cassette sub family G 0.0011 0.0953 0.0953
Toxoplasma gondii histone lysine demethylase JMJC1/KDM5D/JARID1D 0.0017 0.1934 0.1295
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0.0892 0.0892
Brugia malayi ecdysteroid receptor 0.0011 0.0892 0.0892
Schistosoma mansoni jumonji domain containing protein 0.0017 0.1934 0.1934
Trypanosoma cruzi cytochrome P450, putative 0.0013 0.1302 0.046
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0.0892 0.0892
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0.0892 0.0892
Echinococcus granulosus mitogen activated protein kinase 0.0054 0.853 0.853
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0.0892 0.0892
Brugia malayi MAP kinase sur-1 0.0054 0.853 0.853
Onchocerca volvulus Bile acid receptor homolog 0.0011 0.0892 0.5
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0.0892 0.0892
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0054 0.853 1
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0054 0.853 1
Schistosoma mansoni ABC transporter 0.0009 0.0656 0.0656
Echinococcus multilocularis jumonji domain containing 1A 0.0017 0.1934 0.1934
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.0017 0.1934 0.1934
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0.0892 0.0892
Trichomonas vaginalis CMGC family protein kinase 0.0054 0.853 0.5
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0.0892 0.0892
Onchocerca volvulus 0.0011 0.0892 0.5
Mycobacterium tuberculosis Probable conserved transmembrane ATP-binding protein ABC transporter 0.0009 0.0634 0.5
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0054 0.853 1
Echinococcus granulosus ATP binding cassette sub family G 0.0011 0.0953 0.0953
Leishmania major cytochrome p450-like protein 0.0013 0.1302 0.046
Loa Loa (eye worm) jmjC domain-containing protein 0.0017 0.1934 0.1934
Schistosoma mansoni protein phosphatase 2C 0.0017 0.1934 0.1934
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0.0892 0.0892
Schistosoma mansoni jumonji/arid domain-containing protein 0.0062 1 1

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.