Detailed information for compound 1494125

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 565.856 | Formula: C24H19Cl3N4O4S
  • H donors: 2 H acceptors: 4 LogP: 3.33 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 2
  • SMILES: ClCc1nc2N(c3ccc(cc3)S(=O)(=O)N)C3=C(C(c2c(=O)[nH]1)c1ccc(cc1Cl)Cl)C(=O)CCC3
  • InChi: 1S/C24H19Cl3N4O4S/c25-11-19-29-23-22(24(33)30-19)20(15-9-4-12(26)10-16(15)27)21-17(2-1-3-18(21)32)31(23)13-5-7-14(8-6-13)36(28,34)35/h4-10,20H,1-3,11H2,(H2,28,34,35)(H,29,30,33)
  • InChiKey: CUXGSAOSVBSRBW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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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
Echinococcus multilocularis tar DNA binding protein 0.0062 0.2552 0.22
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.0451 0.0682
Schistosoma mansoni hypothetical protein 0.0169 1 1
Loa Loa (eye worm) hypothetical protein 0.01 0.5202 0.7859
Brugia malayi Latrophilin receptor protein 2 0.0032 0.0451 0.0682
Schistosoma mansoni hypothetical protein 0.0169 1 1
Loa Loa (eye worm) hypothetical protein 0.0069 0.3003 0.4537
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.0774 0.0338
Loa Loa (eye worm) RNA binding protein 0.0062 0.2552 0.3855
Brugia malayi TAR-binding protein 0.0062 0.2552 0.3855
Leishmania major hypothetical protein, conserved 0.0025 0 0.5
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0 0.5
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0 0.5
Entamoeba histolytica hypothetical protein 0.0036 0.0774 0.5
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.2552 0.3855
Schistosoma mansoni tar DNA-binding protein 0.0062 0.2552 0.22
Schistosoma mansoni tar DNA-binding protein 0.0062 0.2552 0.22
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.6619 1
Echinococcus granulosus tar DNA binding protein 0.0062 0.2552 0.22
Loa Loa (eye worm) hypothetical protein 0.0032 0.0451 0.0682
Brugia malayi latrophilin 2 splice variant baaae 0.0069 0.3003 0.4537
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0 0.5
Schistosoma mansoni hypothetical protein 0.0036 0.0774 0.0338
Entamoeba histolytica hypothetical protein 0.0036 0.0774 0.5
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.0451 0.0682
Entamoeba histolytica hypothetical protein 0.0036 0.0774 0.5
Loa Loa (eye worm) TAR-binding protein 0.0062 0.2552 0.3855
Schistosoma mansoni tar DNA-binding protein 0.0062 0.2552 0.22
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.01 0.5202 0.7859
Entamoeba histolytica hypothetical protein 0.0036 0.0774 0.5
Brugia malayi MH2 domain containing protein 0.0121 0.6619 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.01 0.5202 0.7859
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.6619 1
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0 0.5
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.0774 0.0338
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.2552 0.3855
Echinococcus multilocularis geminin 0.0169 1 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.2552 0.22
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.01 0.5202 0.7859
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.0774 0.0338
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0 0.5
Brugia malayi hypothetical protein 0.0036 0.0774 0.1169
Schistosoma mansoni hypothetical protein 0.0069 0.3003 0.2672
Brugia malayi RNA binding protein 0.0062 0.2552 0.3855
Schistosoma mansoni tar DNA-binding protein 0.0062 0.2552 0.22
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0 0.5

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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