Detailed information for compound 761593

Basic information

Technical information
  • TDR Targets ID: 761593
  • Name: 2-(4-bromophenyl)-5-(phenylmethylidene)-[1,3] thiazolo[2,3-e][1,2,4]triazol-6-one
  • MW: 388.282 | Formula: C17H14BrN3OS
  • H donors: 0 H acceptors: 3 LogP: 5.01 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc(cc1)C1NC2N(N1)C(=O)C(=Cc1ccccc1)S2
  • InChi: 1S/C17H10BrN3OS/c18-13-8-6-12(7-9-13)15-19-17-21(20-15)16(22)14(23-17)10-11-4-2-1-3-5-11/h1-10H/b14-10-
  • InChiKey: UTMDLJNGZLEKNH-UVTDQMKNSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (5Z)-2-(4-bromophenyl)-5-(phenylmethylidene)-[1,3]thiazolo[2,3-e][1,2,4]triazol-6-one
  • 2-(4-bromophenyl)-5-(phenylmethylene)thiazolo[2,3-e][1,2,4]triazol-6-one
  • (5Z)-2-(4-bromophenyl)-5-(phenylmethylene)thiazolo[2,3-e][1,2,4]triazol-6-one
  • 2-(4-bromophenyl)-5-(phenylmethylene)-6-thiazolo[2,3-e][1,2,4]triazolone
  • (5Z)-2-(4-bromophenyl)-5-(phenylmethylene)-6-thiazolo[2,3-e][1,2,4]triazolone
  • (5Z)-5-(benzylidene)-2-(4-bromophenyl)thiazolo[2,3-e][1,2,4]triazol-6-one
  • 5-(benzylidene)-2-(4-bromophenyl)thiazolo[2,3-e][1,2,4]triazol-6-one

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) histone methyltransferase 0.0018 0.078 0.0772
Schistosoma mansoni myo inositol monophosphatase 0.0011 0.0319 0.0319
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0097 0.6353 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0109 0.7153 1
Schistosoma mansoni zinc finger protein 0.0007 0.0008 0.0008
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Schistosoma mansoni bromodomain containing protein 0.0007 0.0008 0.0008
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0018 0.078 0.0795
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.2641 0.2641
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0123 0.816 0.816
Echinococcus granulosus inositol monophosphatase 0.0011 0.0319 0.0321
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.2641 0.2715
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0044 0.2601 0.5
Trichomonas vaginalis inositol monophosphatase, putative 0.0011 0.0319 0.0427
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Echinococcus multilocularis cpg binding protein 0.0061 0.3825 0.382
Schistosoma mansoni hypothetical protein 0.0011 0.0319 0.0319
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0109 0.7153 1
Trichomonas vaginalis diphosphonucleoside phosphohydrolase, putative 0.0011 0.0319 0.0427
Brugia malayi CXXC zinc finger family protein 0.0058 0.3593 0.3587
Giardia lamblia Histone acetyltransferase GCN5 0.004 0.2345 1
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0014 0.0531 0.0539
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.2641 0.2635
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0442 0.0599
Trichomonas vaginalis bromodomain-containing protein, putative 0.0044 0.2601 0.3624
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative 0.0011 0.0319 0.0447
Schistosoma mansoni inositol monophosphatase 0.0109 0.7153 0.7153
Onchocerca volvulus 0.0058 0.3593 1
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0013 0.0442 0.0599
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Echinococcus granulosus histone acetyltransferase KAT2B 0.0145 0.9706 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0109 0.7153 1
Echinococcus granulosus mixed lineage leukemia protein mll 0.0014 0.0531 0.0539
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0442 0.0599
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0109 0.7153 1
Entamoeba histolytica acetyltransferase, GNAT family 0.004 0.2345 0.3278
Loa Loa (eye worm) inositol-1 0.0109 0.7153 0.7151
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0109 0.7153 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.2641 0.2635
Trichomonas vaginalis helicase, putative 0.0013 0.0442 0.0599
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0013 0.0442 0.0599
Schistosoma mansoni inositol monophosphatase 0.0109 0.7153 0.7153
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0044 0.2601 0.3181
Loa Loa (eye worm) hypothetical protein 0.0011 0.0319 0.0311
Loa Loa (eye worm) CXXC zinc finger family protein 0.0058 0.3593 0.3587
Schistosoma mansoni bromodomain containing protein 0.0007 0.0008 0.0008
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0442 0.0599
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0014 0.0531 0.0531
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.2641 0.2641
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0442 0.0599
Echinococcus granulosus histone acetyltransferase KAT2B 0.0044 0.2601 0.2674
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0109 0.7153 0.9526
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0097 0.6353 1
Schistosoma mansoni cpg binding protein 0.0061 0.3825 0.3825
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.2641 0.2635
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0109 0.7153 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0109 0.7153 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0014 0.0531 0.0523
Echinococcus multilocularis inositol monophosphatase 0.0011 0.0319 0.0311
Brugia malayi F/Y-rich N-terminus family protein 0.0018 0.0764 0.0756
Brugia malayi Inositol monophosphatase family protein 0.0011 0.0319 0.0311
Echinococcus granulosus inositol monophosphatase 1 0.0109 0.7153 0.7368
Schistosoma mansoni cpg binding protein 0.0061 0.3825 0.3825
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0008 0.0104 0.0104
Trichomonas vaginalis inositol monophosphatase, putative 0.0011 0.0319 0.0427
Echinococcus granulosus cpg binding protein 0.0061 0.3825 0.3936
Trichomonas vaginalis conserved hypothetical protein 0.0013 0.0442 0.0599
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0149 1 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0442 0.0599
Schistosoma mansoni cpg binding protein 0.0058 0.3593 0.3593
Echinococcus granulosus 3'2'5' bisphosphate nucleotidase 1 0.0011 0.0319 0.0321
Trichomonas vaginalis inositol monophosphatase, putative 0.0109 0.7153 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.2641 0.2715
Schistosoma mansoni pap-inositol-14-phosphatase 0.0011 0.0319 0.0319
Plasmodium falciparum histone acetyltransferase GCN5 0.004 0.2345 1
Brugia malayi Inositol-1 0.0109 0.7153 0.7151
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0018 0.078 0.0772
Brugia malayi Inositol monophosphatase family protein 0.0011 0.0319 0.0311
Loa Loa (eye worm) acetyltransferase 0.0149 1 1
Schistosoma mansoni hypothetical protein 0.0011 0.0319 0.0319
Echinococcus multilocularis 3'(2'),5' bisphosphate nucleotidase 1 0.0011 0.0319 0.0311
Toxoplasma gondii histone lysine methyltransferase SET1 0.0114 0.7494 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0149 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.2641 0.2641
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0044 0.2601 0.3624
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0014 0.0531 0.0523
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0109 0.7153 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0.0319 0.0311
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0044 0.2601 0.3181
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.2641 0.2635
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0011 0.0319 0.0427
Chlamydia trachomatis 3'(2'),5'-bisphosphate nucleotidase CysQ 0.0011 0.0319 0.5
Echinococcus multilocularis inositol monophosphatase 1 0.0109 0.7153 0.7151
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0109 0.7153 1
Entamoeba histolytica 3(2),5-bisphosphate nucleotidase, putative 0.0011 0.0319 0.0447
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0013 0.0442 0.0599

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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