TDR Targets

Basic information

Technical information

TDR Targets ID: 704736
Name: N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)- N-(2-dimethylaminoethyl)-3-methylbenzamide
MW: 403.926 | Formula: C20H22ClN3O2S
H donors: 0 H acceptors: 2 LogP: 4.73 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(c2c1nc(s2)N(C(=O)c1cccc(c1)C)CCN(C)C)Cl
InChi: 1S/C20H22ClN3O2S/c1-13-6-5-7-14(12-13)19(25)24(11-10-23(2)3)20-22-17-16(26-4)9-8-15(21)18(17)27-20/h5-9,12H,10-11H2,1-4H3
InChiKey: ZKGMSNLYKRDRCJ-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

N-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-methyl-benzamide

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
Loa Loa (eye worm)	acetyltransferase	0.0158	0.3161	0.6337
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0064	0.1187	0.1338
Echinococcus multilocularis	cpg binding protein	0.0032	0.052	0.0508
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0145	0.2899	0.3291
Mycobacterium leprae	putative cytochrome p450	0.0023	0.0333	0.5
Brugia malayi	Cell death specification protein 2	0.001	0.0058	0.009
Leishmania major	3-oxoacyl-(acyl-carrier protein) reductase, putative	0.0063	0.1165	1
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0154	0.3068	0.3059
Brugia malayi	latrophilin 2 splice variant baaae	0.011	0.2158	0.4319
Echinococcus multilocularis	tumor protein p63	0.0368	0.7557	0.7554
Schistosoma mansoni	cytochrome P450	0.0023	0.0333	0.0364
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0051	0.0923	0.1831
Loa Loa (eye worm)	RNA binding protein	0.0143	0.2848	0.5708
Echinococcus granulosus	protocadherin 11	0.001	0.0058	0.0045
Loa Loa (eye worm)	cytochrome P450	0.0023	0.0333	0.0643
Loa Loa (eye worm)	MH2 domain-containing protein	0.0244	0.4963	0.9965
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0145	0.2899	0.3291
Brugia malayi	Hepatic leukemia factor	0.001	0.0058	0.009
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0017	0.0206	0.0193
Entamoeba histolytica	acetyltransferase, GNAT family	0.0043	0.0748	0.4828
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0161	0.3223	0.6462
Schistosoma mansoni	hypothetical protein	0.0051	0.0923	0.1037
Brugia malayi	MH1 domain containing protein	0.0017	0.0206	0.0387
Loa Loa (eye worm)	bZIP transcription factor family protein	0.001	0.0058	0.009
Schistosoma mansoni	transcriptional factor nfil3/e4bp4	0.001	0.0058	0.0051
Brugia malayi	Cytochrome P450 family protein	0.0104	0.2039	0.4079
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0051	0.0923	0.0911
Loa Loa (eye worm)	hypothetical protein	0.001	0.0058	0.009
Mycobacterium leprae	Conserved hypothetical protein	0.0023	0.0333	0.5
Brugia malayi	TAR-binding protein	0.0143	0.2848	0.5708
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription factor	0.001	0.0058	0.0045
Schistosoma mansoni	tar DNA-binding protein	0.0143	0.2848	0.3233
Onchocerca volvulus		0.005	0.0903	0.9154
Brugia malayi	Smad1	0.0017	0.0206	0.0387
Schistosoma mansoni	hypothetical protein	0.005	0.0903	0.1014
Brugia malayi	CXXC zinc finger family protein	0.003	0.0485	0.0949
Loa Loa (eye worm)	TAR-binding protein	0.0143	0.2848	0.5708
Trypanosoma brucei	Lanosterol 14-alpha demethylase	0.0023	0.0333	0.5
Onchocerca volvulus		0.003	0.0485	0.4849
Onchocerca volvulus		0.001	0.0058	0.046
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0923	0.1831
Echinococcus granulosus	dnaJ subfamily B	0.0427	0.8782	0.878
Echinococcus multilocularis	smad	0.0017	0.0206	0.0193
Echinococcus granulosus	survival motor neuron protein 1	0.0245	0.498	0.4973
Echinococcus multilocularis		0.0023	0.0333	0.032
Schistosoma mansoni	hypothetical protein	0.011	0.2158	0.2446
Schistosoma mansoni	smad1 5 8 and	0.0017	0.0206	0.0219
Echinococcus granulosus	mothers against decapentaplegic 5	0.0017	0.0206	0.0193
Brugia malayi	MH1 domain containing protein	0.0009	0.005	0.0074
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0046	0.0829	0.6259
Loa Loa (eye worm)	hypothetical protein	0.001	0.0058	0.009
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0158	0.3161	0.3589
Schistosoma mansoni	hypothetical protein	0.001	0.0058	0.0051
Loa Loa (eye worm)	cytochrome P450 family protein	0.0104	0.2039	0.4079
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0046	0.0829	0.6259
Entamoeba histolytica	hypothetical protein	0.0078	0.1488	1
Brugia malayi	RNA recognition motif domain containing protein	0.0143	0.2848	0.5708
Trypanosoma cruzi	cytochrome p450-like protein, putative	0.0023	0.0333	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0143	0.2848	0.3233
Echinococcus multilocularis	GPCR, family 2	0.0051	0.0923	0.0911
Echinococcus granulosus	cytochrome P450 2K1	0.0023	0.0333	0.032
Schistosoma mansoni	hypothetical protein	0.0051	0.0923	0.1037
Giardia lamblia	Histone acetyltransferase GCN5	0.0043	0.0748	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0145	0.2899	0.581
Brugia malayi	Cytochrome P450 family protein	0.0023	0.0333	0.0643
Loa Loa (eye worm)	MH2 domain-containing protein	0.0017	0.0206	0.0387
Echinococcus granulosus	GPCR family 2	0.0051	0.0923	0.0911
Echinococcus multilocularis	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0063	0.1165	0.1153
Schistosoma mansoni	tar DNA-binding protein	0.0143	0.2848	0.3233
Brugia malayi	MH1 domain containing protein	0.0009	0.005	0.0074
Echinococcus multilocularis	cyclic AMP responsive element binding protein	0.001	0.0058	0.0045
Brugia malayi	3-hydroxyacyl-CoA dehydrogenase type II	0.0063	0.1165	0.2319
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0143	0.2848	0.5708
Schistosoma mansoni	hypothetical protein	0.0023	0.0333	0.0364
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0046	0.0829	0.5
Brugia malayi	Cell death specification protein 2	0.001	0.0058	0.009
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0145	0.2899	0.289
Echinococcus granulosus	transcriptional factor nfil3:e4bp4	0.001	0.0058	0.0045
Loa Loa (eye worm)	MH1 domain-containing protein	0.0017	0.0206	0.0387
Schistosoma mansoni	hypothetical protein	0.0302	0.6177	0.7029
Schistosoma mansoni	Smad4	0.0017	0.0206	0.0219
Entamoeba histolytica	hypothetical protein	0.0078	0.1488	1
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0063	0.1165	1
Schistosoma mansoni	tar DNA-binding protein	0.0143	0.2848	0.3233
Mycobacterium tuberculosis	Probable short-chain type dehydrogenase/reductase	0.0063	0.1165	1
Brugia malayi	hypothetical protein	0.001	0.0058	0.009
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0061	0.1126	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0145	0.2899	0.289
Loa Loa (eye worm)	hypothetical protein	0.001	0.0058	0.009
Brugia malayi	acetyltransferase, GNAT family protein	0.0158	0.3161	0.6337
Brugia malayi	Cytochrome P450 family protein	0.0023	0.0333	0.0643
Echinococcus multilocularis	dnaJ subfamily B	0.0427	0.8782	0.878
Loa Loa (eye worm)	3-hydroxyacyl-CoA dehydrogenase type II	0.0058	0.1077	0.2142
Onchocerca volvulus		0.0054	0.0985	1
Brugia malayi	bZIP transcription factor family protein	0.001	0.0058	0.009
Loa Loa (eye worm)	hypothetical protein	0.001	0.0058	0.009
Echinococcus granulosus	tumor protein p63	0.0368	0.7557	0.7554
Echinococcus granulosus	ccaat enhancer binding protein delta	0.001	0.0058	0.0045
Brugia malayi	MH1 domain containing protein	0.0017	0.0206	0.0387
Loa Loa (eye worm)	Smad1	0.0017	0.0206	0.0387
Loa Loa (eye worm)	hypothetical protein	0.001	0.0058	0.009
Plasmodium falciparum	histone acetyltransferase GCN5	0.0043	0.0748	0.5
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0017	0.0206	0.0193
Brugia malayi	MH2 domain containing protein	0.0017	0.0206	0.0387
Loa Loa (eye worm)	hypothetical protein	0.0161	0.3223	0.6462
Echinococcus multilocularis	protocadherin 11	0.001	0.0058	0.0045
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0046	0.0829	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription factor	0.001	0.0058	0.0045
Echinococcus multilocularis	neuropeptide s receptor	0.0485	1	1
Schistosoma mansoni	transcription factor LCR-F1	0.0078	0.1488	0.1681
Loa Loa (eye worm)	nuclear factor I	0.0009	0.005	0.0074
Schistosoma mansoni	cpg binding protein	0.0032	0.052	0.0578
Schistosoma mansoni	hypothetical protein	0.0051	0.0923	0.1037
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0161	0.3223	0.6462
Loa Loa (eye worm)	hypothetical protein	0.001	0.0058	0.009
Brugia malayi	Latrophilin receptor protein 2	0.0051	0.0923	0.1831
Brugia malayi	MH2 domain containing protein	0.0017	0.0206	0.0387
Loa Loa (eye worm)	hypothetical protein	0.0009	0.005	0.0074
Echinococcus granulosus	cpg binding protein	0.0032	0.052	0.0508
Echinococcus multilocularis	survival motor neuron protein 1	0.0245	0.498	0.4973
Echinococcus multilocularis	tar DNA binding protein	0.0143	0.2848	0.2839
Schistosoma mansoni	smad1 5 8 and	0.0017	0.0206	0.0219
Brugia malayi	Cell death specification protein 2	0.001	0.0058	0.009
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0158	0.3161	0.3151
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0145	0.2899	0.3291
Brugia malayi	hypothetical protein	0.0078	0.1488	0.2968
Echinococcus multilocularis	ccaat enhancer binding protein delta ccaat enhancer binding protein beta	0.001	0.0058	0.0045
Schistosoma mansoni	smad1 5 8 and	0.0017	0.0206	0.0219
Entamoeba histolytica	hypothetical protein	0.0078	0.1488	1
Echinococcus granulosus	smad	0.0017	0.0206	0.0193
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.0023	0.0333	0.5
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0052	0.0038
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0161	0.3223	0.6462
Schistosoma mansoni	cpg binding protein	0.0032	0.052	0.0578
Echinococcus granulosus	X box binding protein 1	0.0302	0.6177	0.6172
Brugia malayi	hypothetical protein	0.0245	0.498	1
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0051	0.0923	0.1831
Echinococcus granulosus	tar DNA binding protein	0.0143	0.2848	0.2839
Schistosoma mansoni	hypothetical protein	0.0078	0.1488	0.1681
Echinococcus multilocularis	protocadherin 11	0.001	0.0058	0.0045
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0051	0.0923	0.0911
Brugia malayi	hypothetical protein	0.001	0.0058	0.009
Trypanosoma brucei	cytochrome P450, putative	0.0023	0.0333	0.5
Echinococcus granulosus	Smad4	0.0017	0.0206	0.0193
Brugia malayi	Cytochrome P450 family protein	0.0023	0.0333	0.0643
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.005	0.0903	0.1791
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0052	0.0077
Echinococcus multilocularis	neuropeptide receptor A26	0.0485	1	1
Trypanosoma cruzi	cytochrome P450, putative	0.0023	0.0333	0.5
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0078	0.1488	0.1476
Loa Loa (eye worm)	cytochrome P450 family protein	0.0023	0.0333	0.0643
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0046	0.0829	0.0817
Schistosoma mansoni	par domain protein	0.001	0.0058	0.0051
Echinococcus granulosus	neuropeptide receptor A26	0.0485	1	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0145	0.2899	0.581
Onchocerca volvulus		0.001	0.0058	0.046
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0046	0.0829	1
Echinococcus granulosus	protocadherin 11	0.001	0.0058	0.0045
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.0049	0.0072
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0017	0.0206	0.0193
Echinococcus granulosus	Basic leucine zipper bZIP transcription factor	0.001	0.0058	0.0045
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0145	0.2899	0.289
Entamoeba histolytica	hypothetical protein	0.0078	0.1488	1
Echinococcus multilocularis	Smad4	0.0017	0.0206	0.0193
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0051	0.0923	0.0911
Onchocerca volvulus		0.001	0.0058	0.046
Loa Loa (eye worm)	hypothetical protein	0.0245	0.498	1
Loa Loa (eye worm)	hypothetical protein	0.011	0.2158	0.4319
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0051	0.0923	0.0911
Trypanosoma cruzi	cytochrome P450, putative	0.0023	0.0333	0.5
Brugia malayi	RNA binding protein	0.0143	0.2848	0.5708
Loa Loa (eye worm)	CYP4Cod1	0.0023	0.0333	0.0643
Schistosoma mansoni	hypothetical protein	0.0427	0.8782	1
Schistosoma mansoni	thyrotroph embryonic factor related	0.001	0.0058	0.0051
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.0023	0.0333	0.5
Echinococcus multilocularis	transcriptional factor nfil3:e4bp4	0.001	0.0058	0.0045
Echinococcus multilocularis	X box binding protein 1	0.0302	0.6177	0.6172
Schistosoma mansoni	3-hydroxyacyl-CoA dehydrogenase	0.0063	0.1165	0.1314
Brugia malayi	hypothetical protein	0.001	0.0058	0.009
Loa Loa (eye worm)	transcription factor SMAD2	0.0244	0.4963	0.9965
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0145	0.2899	0.289
Schistosoma mansoni	survival motor neuron protein	0.005	0.0903	0.1014
Mycobacterium ulcerans	short-chain type dehydrogenase/reductase	0.0063	0.1165	1
Loa Loa (eye worm)	CXXC zinc finger family protein	0.003	0.0485	0.0949
Echinococcus granulosus	3 hydroxyacyl coenzyme A dehydrogenase type 2	0.0063	0.1165	0.1153
Schistosoma mansoni	tar DNA-binding protein	0.0143	0.2848	0.3233
Loa Loa (eye worm)	cytochrome P450 family protein	0.0023	0.0333	0.0643
Loa Loa (eye worm)	cell death specification protein 2	0.001	0.0058	0.009
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription factor	0.001	0.0058	0.0045
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0985	0.1956
Schistosoma mansoni	cpg binding protein	0.003	0.0485	0.0537
Schistosoma mansoni	hypothetical protein	0.0051	0.0923	0.1037
Brugia malayi	cytochrome P450	0.0023	0.0333	0.0643
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0078	0.1488	0.1476
Schistosoma mansoni	cellular tumor antigen P53	0.0054	0.0985	0.1108
Brugia malayi	MH2 domain containing protein	0.0244	0.4963	0.9965
Onchocerca volvulus		0.001	0.0058	0.046
Schistosoma mansoni	hypothetical protein	0.001	0.0058	0.0051
Schistosoma mansoni	smad	0.0017	0.0206	0.0219
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0017	0.0206	0.0219
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0052	0.0038

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 704736