Detailed information for compound 1683407

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 399.273 | Formula: C20H16Cl2N4O
  • H donors: 0 H acceptors: 2 LogP: 3.84 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc2c(c1)C(=NCc1n2cnc1C(=O)N(C)C)c1ccc(cc1)Cl
  • InChi: 1S/C20H16Cl2N4O/c1-25(2)20(27)19-17-10-23-18(12-3-5-13(21)6-4-12)15-9-14(22)7-8-16(15)26(17)11-24-19/h3-9,11H,10H2,1-2H3
  • InChiKey: FYBXFXROYOWPGW-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
Schistosoma mansoni hypothetical protein 0.0016 0.2153 0.2153
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0542 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.8077 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0004 0.0127 0.0127
Schistosoma mansoni hypothetical protein 0.0016 0.2153 0.2153
Echinococcus multilocularis GPCR, family 2 0.0016 0.2153 0.2203
Onchocerca volvulus 0.0029 0.4403 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.7469 0.9149
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0956 0.0446
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.2153 0.1681
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.7469 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.2153 0.2203
Schistosoma mansoni cpg binding protein 0.003 0.4688 0.4688
Echinococcus granulosus cpg binding protein 0.003 0.4688 0.5921
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0956 0.0446
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.8077 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.2153 0.1681
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.7469 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.7469 1
Brugia malayi CXXC zinc finger family protein 0.0029 0.4403 0.4856
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0542 1
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.5335 0.616
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0542 1
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0651 0.0651
Plasmodium falciparum zinc finger protein, putative 0.0003 0 0.5
Brugia malayi Latrophilin receptor protein 2 0.0016 0.2153 0.1704
Schistosoma mansoni hypothetical protein 0.0016 0.2153 0.2153
Schistosoma mansoni cpg binding protein 0.0029 0.4403 0.4403
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.7469 0.7469
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.2153 0.1704
Loa Loa (eye worm) hypothetical protein 0.0034 0.5335 0.615
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.2153 0.2203
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.2153 0.2203
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.7469 0.9146
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0542 1
Entamoeba histolytica hypothetical protein 0.0003 0 0.5
Trichomonas vaginalis helicase, putative 0.0007 0.0542 1
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.7469 0.7469
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0542 1
Echinococcus granulosus GPCR family 2 0.0016 0.2153 0.2203
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Trichomonas vaginalis conserved hypothetical protein 0.0007 0.0542 1
Schistosoma mansoni cpg binding protein 0.003 0.4688 0.4688
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0007 0.0542 1
Schistosoma mansoni hypothetical protein 0.0034 0.5335 0.5335
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0542 1
Loa Loa (eye worm) hypothetical protein 0.005 0.8077 1
Echinococcus multilocularis cpg binding protein 0.003 0.4688 0.5921
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.7469 0.7469
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.7469 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.8869 0.5
Schistosoma mansoni hypothetical protein 0.0016 0.2153 0.2153
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.2153 0.2203
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.8077 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.4403 0.4842
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0007 0.0542 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.

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