Detailed information for compound 1480420

Basic information

Technical information
  • TDR Targets ID: 1480420
  • Name: 4-(4-bromophenyl)-2-(2,2-dimethylthian-4-yl)- 1,3-thiazole
  • MW: 368.355 | Formula: C16H18BrNS2
  • H donors: 0 H acceptors: 1 LogP: 5.15 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc(cc1)c1csc(n1)C1CCSC(C1)(C)C
  • InChi: 1S/C16H18BrNS2/c1-16(2)9-12(7-8-20-16)15-18-14(10-19-15)11-3-5-13(17)6-4-11/h3-6,10,12H,7-9H2,1-2H3
  • InChiKey: MFYBJCVTOBFISX-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 4-(4-bromophenyl)-2-(2,2-dimethyltetrahydrothiopyran-4-yl)thiazole
  • 4-(4-bromophenyl)-2-(2,2-dimethyl-4-tetrahydrothiopyranyl)thiazole
  • STOCK1S-53589

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
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0108 0.2477 1
Loa Loa (eye worm) hypothetical protein 0.0043 0.0868 0.1304
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0084 0.1874 0.3165
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0088 0.198 0.198
Echinococcus granulosus mothers against decapentaplegic 6 0.0008 0.0008 0.0008
Loa Loa (eye worm) MH2 domain-containing protein 0.0017 0.0237 0.0347
Loa Loa (eye worm) RecQ helicase 0.0203 0.4791 0.7251
Echinococcus granulosus cpg binding protein 0.0031 0.0578 0.0578
Brugia malayi MH2 domain containing protein 0.0249 0.5903 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.045 0.0083
Loa Loa (eye worm) Smad1 0.0017 0.0237 0.0347
Echinococcus granulosus GPCR family 2 0.0049 0.1018 0.1018
Brugia malayi MH2 domain containing protein 0.0017 0.0237 0.0389
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0084 0.1874 0.3848
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.1338 0.1338
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0961 0.0961
Loa Loa (eye worm) 3'-5' exonuclease 0.0025 0.0433 0.0644
Brugia malayi MH1 domain containing protein 0.0009 0.0052 0.0075
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0961 0.0961
Schistosoma mansoni hypothetical protein 0.0088 0.198 0.198
Trichomonas vaginalis conserved hypothetical protein 0.0025 0.0433 0.0016
Echinococcus granulosus Smad4 0.0017 0.0237 0.0237
Loa Loa (eye worm) hypothetical protein 0.0088 0.198 0.2989
Schistosoma mansoni Smad4 0.0017 0.0237 0.0237
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0011 0.0104 0.0104
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.045 0.0063
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0049 0.1018 0.1714
Echinococcus granulosus mothers against decapentaplegic 2 0.0008 0.0008 0.0008
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0017 0.0237 0.0237
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0084 0.1874 0.5317
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0049 0.1018 0.1018
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0154 0.3602 0.5448
Brugia malayi MH2 domain containing protein 0.0017 0.0237 0.0389
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0044 0.0044
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0011 0.0104 0.0104
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0108 0.2477 1
Loa Loa (eye worm) transcription factor SMAD2 0.0249 0.5903 0.8936
Schistosoma mansoni hypothetical protein 0.0353 0.8453 0.8453
Brugia malayi MH1 domain containing protein 0.0009 0.0052 0.0075
Schistosoma mansoni cpg binding protein 0.0031 0.0578 0.0578
Brugia malayi latrophilin 2 splice variant baaae 0.0106 0.2406 0.4068
Schistosoma mansoni Smad4 0.0008 0.0008 0.0008
Brugia malayi hypothetical protein 0.0017 0.0227 0.0373
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0961 0.0961
Schistosoma mansoni Smad4 0.0008 0.0008 0.0008
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0084 0.1874 0.1874
Brugia malayi F/Y-rich N-terminus family protein 0.0009 0.0041 0.0056
Loa Loa (eye worm) latrophilin receptor protein 2 0.0049 0.1018 0.1532
Entamoeba histolytica recQ family DNA helicase 0.0043 0.0868 0.2129
Loa Loa (eye worm) MH1 domain-containing protein 0.0017 0.0237 0.0347
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0961 0.0961
Schistosoma mansoni blooms syndrome DNA helicase 0.0043 0.0868 0.0868
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0961 0.0961
Entamoeba histolytica recQ family helicase, putative 0.0108 0.2477 1
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0084 0.1874 0.3165
Schistosoma mansoni DNA helicase recq5 0.0084 0.1874 0.1874
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.045 0.0062
Loa Loa (eye worm) hypothetical protein 0.0277 0.6605 1
Schistosoma mansoni blooms syndrome DNA helicase 0.016 0.3746 0.3746
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0537 0.0802
Echinococcus multilocularis mothers against decapentaplegic 5 0.0017 0.0237 0.0237
Schistosoma mansoni apoptosis regulator bax 0.0088 0.198 0.198
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0088 0.198 0.198
Schistosoma mansoni cpg binding protein 0.0029 0.0537 0.0537
Echinococcus granulosus TGF beta signal transducer SmadC 0.0017 0.0237 0.0237
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0084 0.1874 0.1874
Schistosoma mansoni smad 0.0008 0.0008 0.0008
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0084 0.1874 0.1874
Schistosoma mansoni hypothetical protein 0.0416 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.2406 0.3635
Loa Loa (eye worm) hypothetical protein 0.0009 0.0052 0.0067
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0084 0.1874 0.5317
Giardia lamblia Sgs1 DNA helicase, putative 0.0084 0.1874 0.5
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.045 0.0083
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0088 0.198 0.198
Loa Loa (eye worm) hypothetical protein 0.0026 0.045 0.067
Echinococcus granulosus geminin 0.0353 0.8453 0.8453
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.045 0.0063
Mycobacterium leprae conserved hypothetical protein 0.0025 0.0433 0.5
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0084 0.1874 0.1874
Echinococcus multilocularis smad 0.0017 0.0237 0.0237
Brugia malayi CXXC zinc finger family protein 0.0029 0.0537 0.0898
Mycobacterium tuberculosis Conserved hypothetical alanine rich protein 0.0025 0.0433 1
Treponema pallidum ATP-dependent DNA helicase 0.0043 0.0868 0.5
Brugia malayi MH1 domain containing protein 0.0017 0.0237 0.0389
Trichomonas vaginalis DNA helicase recq, putative 0.0108 0.2477 0.4699
Echinococcus multilocularis mothers against decapentaplegic 6 0.0008 0.0008 0.0008
Entamoeba histolytica recQ family helicase, putative 0.0041 0.0828 0.1934
Schistosoma mansoni smad1 5 8 and 0.0017 0.0237 0.0237
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0178 0.4188 1
Schistosoma mansoni hypothetical protein 0.0049 0.1018 0.1018
Schistosoma mansoni hypothetical protein 0.0011 0.0104 0.0104
Echinococcus granulosus bloom syndrome protein 0.0203 0.4791 0.4791
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0108 0.2477 1
Echinococcus multilocularis Helicase RNase D C terminal, HRDC domain 0.0025 0.0433 0.0433
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0961 0.1617
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0088 0.198 0.198
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0961 0.0961
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0017 0.0237 0.0237
Mycobacterium ulcerans hypothetical protein 0.0025 0.0433 1
Loa Loa (eye worm) histone methyltransferase 0.0009 0.0044 0.0054
Schistosoma mansoni smad1 5 8 and 0.0017 0.0237 0.0237
Echinococcus multilocularis bloom syndrome protein 0.0203 0.4791 0.4791
Echinococcus multilocularis geminin 0.0353 0.8453 0.8453
Loa Loa (eye worm) nuclear factor I 0.0009 0.0052 0.0067
Loa Loa (eye worm) hypothetical protein 0.0049 0.1018 0.1532
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0154 0.3602 0.6097
Echinococcus multilocularis dnaJ subfamily B 0.0416 1 1
Brugia malayi MH1 domain containing protein 0.0017 0.0237 0.0389
Plasmodium vivax exosome complex exonuclease RRP6, putative 0.0025 0.0433 0.0025
Plasmodium vivax ATP-dependent DNA helicase Q1, putative 0.0041 0.0828 0.1459
Echinococcus multilocularis GPCR, family 2 0.0049 0.1018 0.1018
Loa Loa (eye worm) hypothetical protein 0.0084 0.1874 0.2828
Trichomonas vaginalis DNA helicase recq1, putative 0.0203 0.4791 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0154 0.3602 0.6097
Schistosoma mansoni hypothetical protein 0.0049 0.1018 0.1018
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0088 0.198 0.3345
Schistosoma mansoni hypothetical protein 0.0049 0.1018 0.1018
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0961 0.0961
Echinococcus granulosus mothers against decapentaplegic 5 0.0017 0.0237 0.0237
Schistosoma mansoni polymyositis/scleroderma autoantigen-related 0.0025 0.0433 0.0433
Loa Loa (eye worm) hypothetical protein 0.0154 0.3602 0.5448
Echinococcus multilocularis cpg binding protein 0.0031 0.0578 0.0578
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.0137 0.3182 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.1176 0.2744
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0088 0.198 0.198
Brugia malayi 3'-5' exonuclease family protein 0.0025 0.0433 0.0721
Loa Loa (eye worm) apoptosis regulator protein 0.0088 0.198 0.2989
Brugia malayi Bloom's syndrome protein homolog 0.0203 0.4791 0.8115
Loa Loa (eye worm) MH2 domain-containing protein 0.0249 0.5903 0.8936
Schistosoma mansoni cpg binding protein 0.0031 0.0578 0.0578
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0136 0.3142 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0049 0.1018 0.1018
Schistosoma mansoni smad 0.0017 0.0237 0.0237
Schistosoma mansoni DNA helicase recq1 0.0084 0.1874 0.1874
Schistosoma mansoni hypothetical protein 0.0088 0.198 0.198
Onchocerca volvulus 0.0029 0.0537 1
Leishmania major hypothetical protein, conserved 0.0026 0.045 0.0083
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0084 0.1874 0.2828
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.045 0.0086
Schistosoma mansoni hypothetical protein 0.0106 0.2406 0.2406
Trichomonas vaginalis DNA helicase recq, putative 0.0203 0.4791 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0049 0.1018 0.1018
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0043 0.0868 0.1606
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0961 0.1445
Schistosoma mansoni hypothetical protein 0.0088 0.198 0.198
Brugia malayi hypothetical protein 0.0026 0.045 0.075
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0049 0.1018 0.1018
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0043 0.0868 0.2129
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0044 0.0044
Echinococcus multilocularis Smad4 0.0017 0.0237 0.0237
Schistosoma mansoni smad1 5 8 and 0.0017 0.0237 0.0237
Echinococcus granulosus Helicase RNase D C terminal HRDC domain 0.0025 0.0433 0.0433
Echinococcus multilocularis mothers against decapentaplegic 2 0.0008 0.0008 0.0008
Brugia malayi Latrophilin receptor protein 2 0.0049 0.1018 0.1714
Schistosoma mansoni hypothetical protein 0.0049 0.1018 0.1018
Brugia malayi Smad1 0.0017 0.0237 0.0389
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.045 0.0083
Echinococcus granulosus smad 0.0017 0.0237 0.0237
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0043 0.0868 0.2129
Schistosoma mansoni hypothetical protein 0.0353 0.8453 0.8453

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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