TDR Targets

Basic information

Technical information

TDR Targets ID: 621412
Name: 4-(4-bromophenoxy)-N-[5-[(4-methylphenyl)meth yl]-1,3-thiazol-2-yl]butanamide
MW: 445.373 | Formula: C21H21BrN2O2S
H donors: 1 H acceptors: 2 LogP: 5.43 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Nc1ncc(s1)Cc1ccc(cc1)C)CCCOc1ccc(cc1)Br
InChi: 1S/C21H21BrN2O2S/c1-15-4-6-16(7-5-15)13-19-14-23-21(27-19)24-20(25)3-2-12-26-18-10-8-17(22)9-11-18/h4-11,14H,2-3,12-13H2,1H3,(H,23,24,25)
InChiKey: JCOCBJSHVOCNHD-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

4-(4-bromophenoxy)-N-[5-[(4-methylphenyl)methyl]thiazol-2-yl]butanamide
4-(4-bromophenoxy)-N-[5-[(4-methylphenyl)methyl]-2-thiazolyl]butanamide
4-(4-bromophenoxy)-N-[5-(4-methylbenzyl)thiazol-2-yl]butyramide
ZINC01769918

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
Leishmania major	hypothetical protein, conserved	0.0074	0.0446	0.4691
Loa Loa (eye worm)	hypothetical protein	0.011	0.0786	0.271
Schistosoma mansoni	hypothetical protein	0.0108	0.0766	0.2057
Echinococcus multilocularis	lamin dm0	0.0112	0.0805	0.0604
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0054	0.0253	0.004
Toxoplasma gondii	LsmAD domain-containing protein	0.0128	0.0952	1
Brugia malayi	cytoplasmic intermediate filament protein	0.006	0.031	0.1069
Schistosoma mansoni	tar DNA-binding protein	0.0332	0.2898	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0074	0.0446	0.5
Trichomonas vaginalis	D-aminoacylase, putative	0.0074	0.0446	0.5
Plasmodium falciparum	ataxin-2 like protein, putative	0.0128	0.0952	0.5
Echinococcus granulosus	intermediate filament protein	0.0112	0.0805	0.0604
Loa Loa (eye worm)	RNA binding protein	0.0332	0.2898	1
Schistosoma mansoni	tar DNA-binding protein	0.0332	0.2898	1
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0054	0.0253	0.004
Plasmodium falciparum	ataxin-2 like protein, putative	0.0128	0.0952	0.5
Brugia malayi	hypothetical protein	0.0082	0.0522	0.18
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0113	0.0814	0.0613
Brugia malayi	beta-lactamase	0.0074	0.0446	0.154
Trichomonas vaginalis	esterase, putative	0.0074	0.0446	0.5
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0446	0.154
Brugia malayi	hypothetical protein	0.0113	0.0814	0.2809
Mycobacterium tuberculosis	Probable lipase LipE	0.0074	0.0446	0.1047
Mycobacterium tuberculosis	Conserved protein	0.0074	0.0446	0.1047
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0074	0.0446	1
Mycobacterium ulcerans	esterase/lipase LipP	0.0074	0.0446	1
Mycobacterium leprae	Probable lipase LipE	0.0074	0.0446	1
Onchocerca volvulus		0.0112	0.0805	0.6491
Schistosoma mansoni	transcription factor LCR-F1	0.0113	0.0814	0.2236
Echinococcus granulosus	lamin dm0	0.0112	0.0805	0.0604
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0158	0.1242	0.4285
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0074	0.0446	0.0866
Mycobacterium ulcerans	lipase LipD	0.0074	0.0446	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0253	0.0873
Echinococcus multilocularis	tumor protein p63	0.1079	1	1
Trypanosoma cruzi	PAB1-binding protein , putative	0.0128	0.0952	1
Schistosoma mansoni	hypothetical protein	0.0057	0.0282	0.0255
Brugia malayi	beta-lactamase family protein	0.0074	0.0446	0.154
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0234	0.0806
Onchocerca volvulus		0.0074	0.0446	0.3599
Entamoeba histolytica	hypothetical protein	0.0113	0.0814	1
Brugia malayi	Intermediate filament tail domain containing protein	0.0112	0.0805	0.2778
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0446	0.154
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0446	0.154
Loa Loa (eye worm)	hypothetical protein	0.0108	0.0766	0.2643
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0057	0.0282	0.007
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0158	0.1242	0.4285
Brugia malayi	beta-lactamase family protein	0.0074	0.0446	0.154
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0074	0.0446	0.1047
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0074	0.0446	0.1047
Entamoeba histolytica	hypothetical protein	0.0113	0.0814	1
Leishmania major	hypothetical protein, conserved	0.0128	0.0952	1
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0446	0.154
Brugia malayi	Latrophilin receptor protein 2	0.005	0.0214	0.0738
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.005	0.0214	0.0738
Mycobacterium tuberculosis	Conserved protein	0.0074	0.0446	0.1047
Trypanosoma cruzi	PAB1-binding protein , putative	0.0128	0.0952	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0074	0.0446	0.5
Loa Loa (eye worm)	MH2 domain-containing protein	0.0262	0.2231	0.7699
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0332	0.2898	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0074	0.0446	0.0866
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0057	0.0282	0.007
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0074	0.0446	0.0238
Trichomonas vaginalis	D-aminoacylase, putative	0.0074	0.0446	0.5
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0112	0.0805	0.2778
Echinococcus granulosus	beta LACTamase domain containing family member	0.0074	0.0446	0.0238
Schistosoma mansoni	intermediate filament proteins	0.0112	0.0805	0.2202
Loa Loa (eye worm)	hypothetical protein	0.0112	0.0805	0.2778
Brugia malayi	RNA binding protein	0.0332	0.2898	1
Echinococcus multilocularis	lamin	0.0112	0.0805	0.0604
Mycobacterium tuberculosis	Probable esterase LipL	0.0074	0.0446	0.1047
Trichomonas vaginalis	penicillin-binding protein, putative	0.0074	0.0446	0.5
Mycobacterium tuberculosis	Probable hydrolase	0.0074	0.0446	0.1047
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0476	0.4263	1
Echinococcus granulosus	lamin	0.0112	0.0805	0.0604
Schistosoma mansoni	tar DNA-binding protein	0.0332	0.2898	1
Schistosoma mansoni	tar DNA-binding protein	0.0332	0.2898	1
Trypanosoma brucei	PAB1-binding protein , putative	0.0128	0.0952	1
Onchocerca volvulus		0.0074	0.0446	0.3599
Brugia malayi	TAR-binding protein	0.0332	0.2898	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0158	0.1242	0.4285
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0446	0.154
Loa Loa (eye worm)	hypothetical protein	0.0158	0.124	0.4279
Schistosoma mansoni	lamin	0.0112	0.0805	0.2202
Loa Loa (eye worm)	hypothetical protein	0.0158	0.1242	0.4285
Schistosoma mansoni	tar DNA-binding protein	0.0332	0.2898	1
Echinococcus granulosus	tar DNA binding protein	0.0332	0.2898	0.2743
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0074	0.0446	0.154
Onchocerca volvulus		0.0074	0.0446	0.3599
Mycobacterium tuberculosis	Conserved protein	0.0074	0.0446	0.1047
Echinococcus multilocularis	musashi	0.0112	0.0805	0.0604
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0074	0.0446	0.1047
Loa Loa (eye worm)	beta-lactamase	0.0074	0.0446	0.154
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0074	0.0446	0.154
Onchocerca volvulus		0.0112	0.0805	0.6491
Schistosoma mansoni	hypothetical protein	0.0113	0.0814	0.2236
Brugia malayi	MH2 domain containing protein	0.0262	0.2231	0.7699
Echinococcus multilocularis	tar DNA binding protein	0.0332	0.2898	0.2743
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0446	0.154
Entamoeba histolytica	hypothetical protein	0.0113	0.0814	1
Loa Loa (eye worm)	latrophilin receptor protein 2	0.005	0.0214	0.0738
Mycobacterium ulcerans	beta-lactamase	0.0074	0.0446	1
Schistosoma mansoni	cellular tumor antigen P53	0.0158	0.124	0.3824
Loa Loa (eye worm)	hypothetical protein	0.005	0.0214	0.0738
Brugia malayi	intermediate filament protein	0.0112	0.0805	0.2778
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0234	0.0806
Plasmodium vivax	ataxin-2 like protein, putative	0.0128	0.0952	1
Mycobacterium ulcerans	hypothetical protein	0.0074	0.0446	1
Mycobacterium leprae	conserved hypothetical protein	0.0074	0.0446	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0108	0.0766	0.2643
Schistosoma mansoni	lamin	0.0112	0.0805	0.2202
Loa Loa (eye worm)	intermediate filament protein	0.0112	0.0805	0.2778
Onchocerca volvulus		0.0158	0.124	1
Mycobacterium tuberculosis	Probable lipase LipD	0.0074	0.0446	0.1047
Loa Loa (eye worm)	hypothetical protein	0.0128	0.0952	0.3283
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.006	0.031	0.1069
Brugia malayi	hypothetical protein	0.0128	0.0952	0.3283
Entamoeba histolytica	hypothetical protein	0.0113	0.0814	1
Brugia malayi	RNA recognition motif domain containing protein	0.0332	0.2898	1
Loa Loa (eye worm)	transcription factor SMAD2	0.0262	0.2231	0.7699
Loa Loa (eye worm)	TAR-binding protein	0.0332	0.2898	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0113	0.0814	0.0613

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

Search by Saint Jude

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 621412