TDR Targets

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

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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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

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

ChEMBL: CHEMBL1616613

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.

Detailed information for compound 1480420