TDR Targets

Basic information

Technical information

TDR Targets ID: 1620585
Name: 2-(4-ethoxy-3,5-dimethoxyphenyl)-5-ethyl-[1,3 ]thiazolo[2,3-e][1,2,4]triazol-6-one
MW: 349.405 | Formula: C16H19N3O4S
H donors: 0 H acceptors: 3 LogP: 3.41 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCOc1c(OC)cc(cc1OC)c1nc2n(n1)C(=O)C(S2)CC
InChi: 1S/C16H19N3O4S/c1-5-12-15(20)19-16(24-12)17-14(18-19)9-7-10(21-3)13(23-6-2)11(8-9)22-4/h7-8,12H,5-6H2,1-4H3
InChiKey: HSEMDYYMCJJVGV-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

2-(4-ethoxy-3,5-dimethoxy-phenyl)-5-ethyl-thiazolo[2,3-e][1,2,4]triazol-6-one
2-(4-ethoxy-3,5-dimethoxyphenyl)-5-ethyl-6-thiazolo[2,3-e][1,2,4]triazolone
2-(4-ethoxy-3,5-dimethoxy-phenyl)-5-ethyl-[1,3]thiazolo[2,3-e][1,2,4]triazol-6-one
2-(4-Ethoxy-3,5-dimethoxyphenyl)-5-ethyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
AIDS-142949
AIDS142949
NSC661836
NCI60_021472

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
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0105	0.0399	0.0352
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.0552	0.2987	0.5
Onchocerca volvulus	Ubiquitin thioesterase ZRANB1 homolog	0.0552	0.2987	0.3369
Loa Loa (eye worm)	hypothetical protein	0.0062	0.0152	0.0118
Echinococcus granulosus	tyrosine kinase	0.0105	0.0399	0.0352
Schistosoma mansoni	hypothetical protein	0.1552	0.8769	1
Chlamydia trachomatis	DNA topoisomerase I	0.1552	0.8769	0.5
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0135	0.0576	0.0529
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.0075	0.0225	0.0177
Echinococcus granulosus	tyrosine protein kinase Blk	0.0105	0.0399	0.0352
Schistosoma mansoni	brg-1 associated factor	0.1552	0.8769	1
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0105	0.0399	0.0399
Schistosoma mansoni	cellular tumor antigen P53	0.0258	0.1288	0.1426
Schistosoma mansoni	tyrosine kinase	0.0044	0.0049	0.0005
Echinococcus multilocularis	growth factor receptor bound protein 2	0.0062	0.0152	0.0152
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0135	0.0576	0.0576
Onchocerca volvulus		0.0552	0.2987	0.3369
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0135	0.0576	0.0576
Echinococcus multilocularis	epidermal growth factor receptor	0.0134	0.0571	0.0571
Schistosoma mansoni	tyrosine kinase	0.0134	0.0571	0.0604
Echinococcus multilocularis	SWI:SNF matrix associated	0.1552	0.8769	0.8769
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0552	0.2987	0.3369
Trypanosoma brucei	hypothetical protein, conserved	0.0552	0.2987	0.5
Echinococcus multilocularis	NCK adaptor protein	0.0062	0.0152	0.0152
Echinococcus multilocularis	Nuclear pore complex protein Nup153	0.0552	0.2987	0.2987
Schistosoma mansoni	zinc finger protein	0.0552	0.2987	0.3373
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0135	0.0576	0.0529
Schistosoma mansoni	hypothetical protein	0.1552	0.8769	1
Echinococcus granulosus	epidermal growth factor receptor	0.0134	0.0571	0.0525
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0062	0.0152	0.0118
Schistosoma mansoni	tyrosine kinase	0.0135	0.0576	0.0609
Echinococcus multilocularis	Upstream activation factor subunit UAF30	0.1552	0.8769	0.8769
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.1552	0.8769	1
Onchocerca volvulus		0.0552	0.2987	0.3369
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.0552	0.2987	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0135	0.0576	0.0576
Schistosoma mansoni	tyrosine kinase	0.0122	0.0497	0.0519
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0092	0.0326	0.0278
Leishmania major	hypothetical protein, conserved	0.0552	0.2987	0.5
Echinococcus multilocularis	tyrosine protein kinase HCK	0.0073	0.0218	0.0218
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0105	0.0399	0.0399
Echinococcus multilocularis	c src tyrosine kinase	0.0075	0.0225	0.0225
Loa Loa (eye worm)	SWIB/MDM2 domain-containing protein	0.1552	0.8769	1
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0283	0.1429	0.1387
Echinococcus granulosus	insulin receptor	0.0283	0.1429	0.1387
Trypanosoma cruzi	hypothetical protein, conserved	0.0552	0.2987	0.5
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0135	0.0576	0.0576
Schistosoma mansoni	tyrosine kinase	0.0134	0.0571	0.0604
Echinococcus multilocularis	zinc finger protein Ran binding	0.0552	0.2987	0.2987
Echinococcus granulosus	Upstream activation factor subunit UAF30	0.1552	0.8769	0.8763
Schistosoma mansoni	RNA binding protein	0.0552	0.2987	0.3373
Leishmania major	hypothetical protein, conserved	0.0552	0.2987	0.5
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0135	0.0576	0.0576
Echinococcus granulosus	zinc finger protein Ran binding	0.0552	0.2987	0.2952
Trichomonas vaginalis	conserved hypothetical protein	0.1552	0.8769	0.5
Echinococcus multilocularis	insulin receptor	0.0283	0.1429	0.1429
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0135	0.0576	0.0576
Brugia malayi	brahma associated protein 60 kDa	0.1552	0.8769	1
Loa Loa (eye worm)	hypothetical protein	0.0552	0.2987	0.3369
Trypanosoma cruzi	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.0552	0.2987	0.5
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0134	0.0571	0.0599
Chlamydia trachomatis	SWIB complex protein	0.1552	0.8769	0.5
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0135	0.0576	0.0576
Onchocerca volvulus		0.0258	0.1288	0.1421
Plasmodium falciparum	SWIB/MDM2 domain-containing protein	0.1552	0.8769	1
Brugia malayi	Protein kinase domain containing protein	0.0161	0.0726	0.0776
Schistosoma mansoni	growth factor receptor-bound protein	0.0062	0.0152	0.0123
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.0075	0.0225	0.0207
Leishmania major	hypothetical protein, conserved	0.0552	0.2987	0.5
Plasmodium vivax	hypothetical protein, conserved	0.1552	0.8769	0.5
Echinococcus multilocularis	tyrosine protein kinase shark	0.0044	0.0049	0.0049
Schistosoma mansoni	tyrosine kinase	0.0122	0.0497	0.0519
Onchocerca volvulus		0.0552	0.2987	0.3369
Echinococcus multilocularis	epidermal growth factor receptor	0.0134	0.0571	0.0571
Brugia malayi	Tyrosine-protein kinase abl-1	0.0075	0.0225	0.0202
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0075	0.0225	0.0225
Schistosoma mansoni	adapter molecule crk	0.0062	0.0152	0.0123
Schistosoma mansoni	tyrosine kinase	0.0134	0.0571	0.0604
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0092	0.0326	0.0326
Leishmania major	hypothetical protein, conserved	0.0552	0.2987	0.5
Schistosoma mansoni	nck2/grb4	0.0062	0.0152	0.0123
Echinococcus granulosus	epidermal growth factor receptor	0.0134	0.0571	0.0525
Loa Loa (eye worm)	hypothetical protein	0.0552	0.2987	0.3369
Brugia malayi	Variant SH3 domain containing protein	0.0062	0.0152	0.0118
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase abl1	0.0062	0.0152	0.0123
Leishmania major	hypothetical protein, conserved	0.0552	0.2987	0.5
Toxoplasma gondii	SWIB/MDM2 domain-containing protein	0.1552	0.8769	1
Echinococcus granulosus	ring and YY1 binding protein	0.0552	0.2987	0.2952
Schistosoma mansoni	tyrosine kinase	0.0283	0.1429	0.1587
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0552	0.2987	0.3369
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0283	0.1429	0.1429
Echinococcus granulosus	growth factor receptor bound protein 2	0.0062	0.0152	0.0103
Loa Loa (eye worm)	hypothetical protein	0.0258	0.1288	0.1421
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0105	0.0399	0.0399
Schistosoma mansoni	tyrosine kinase	0.0075	0.0225	0.0207
Echinococcus granulosus	tyrosine protein kinase HCK	0.0073	0.0218	0.017
Echinococcus granulosus	melanoma receptor tyrosine protein kinase	0.0134	0.0571	0.0525
Loa Loa (eye worm)	hypothetical protein	0.0552	0.2987	0.3369
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0135	0.0576	0.0529
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.0044	0.0049	0.0049
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0135	0.0576	0.0529
Trypanosoma cruzi	hypothetical protein, conserved	0.0552	0.2987	0.5
Loa Loa (eye worm)	brahma associated protein	0.1552	0.8769	1
Echinococcus multilocularis	SWI:SNF matrix associated	0.1552	0.8769	0.8769
Schistosoma mansoni	hypothetical protein	0.1552	0.8769	1
Brugia malayi	Sex muscle abnormal protein 5	0.0062	0.0152	0.0118
Trypanosoma cruzi	Zn-finger in Ran binding protein and others, putative	0.0552	0.2987	0.5
Schistosoma mansoni	hypothetical protein	0.0552	0.2987	0.3373
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0135	0.0576	0.0529
Echinococcus multilocularis	Zinc finger, RanBP2 type	0.0552	0.2987	0.2987
Brugia malayi	Protein kinase domain containing protein	0.0283	0.1429	0.1582
Echinococcus granulosus	c src tyrosine kinase	0.0075	0.0225	0.0177
Loa Loa (eye worm)	hypothetical protein	0.0552	0.2987	0.3369
Brugia malayi	SWIB/MDM2 domain containing protein	0.1552	0.8769	1
Echinococcus granulosus	NCK adaptor protein	0.0062	0.0152	0.0103
Loa Loa (eye worm)	hypothetical protein	0.0552	0.2987	0.3369
Schistosoma mansoni	tyrosine kinase	0.0135	0.0576	0.0609
Brugia malayi	Variant SH3 domain containing protein	0.0062	0.0152	0.0118
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.0075	0.0225	0.0225
Brugia malayi	protein-tyrosine kinase	0.0105	0.0399	0.0402
Echinococcus granulosus	Zinc finger RanBP2 type	0.0552	0.2987	0.2952
Loa Loa (eye worm)	hypothetical protein	0.0148	0.0652	0.0692
Onchocerca volvulus	Tyrosine kinase homolog	0.0304	0.1555	0.1727
Trypanosoma cruzi	hypothetical protein, conserved	0.0552	0.2987	0.5
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0135	0.0576	0.0576
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0135	0.0576	0.0529
Echinococcus granulosus	Nuclear pore complex protein Nup153	0.0552	0.2987	0.2952
Schistosoma mansoni	tyrosine kinase	0.0283	0.1429	0.1587
Schistosoma mansoni	TRABID protein (C64 family)	0.0552	0.2987	0.3373
Onchocerca volvulus		0.0287	0.1453	0.161
Brugia malayi	YY1-associated factor 2	0.0552	0.2987	0.3369
Trypanosoma brucei	Zn-finger in Ran binding protein and others/FYVE zinc finger, putative	0.0552	0.2987	0.5
Plasmodium vivax	SWIB/MDM2 domain-containing protein, putative	0.1552	0.8769	0.5
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0325	0.1675	0.1864
Loa Loa (eye worm)	SRC-1	0.0135	0.0576	0.0604
Loa Loa (eye worm)	TK protein kinase	0.0073	0.0218	0.0194
Trypanosoma brucei	mitochondrial RNA binding complex 1 subunit	0.0552	0.2987	0.5
Brugia malayi	brahma associated protein 60 kDa	0.1552	0.8769	1
Schistosoma mansoni	tyrosine kinase	0.0122	0.0497	0.0519
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0552	0.2987	0.3369
Trypanosoma brucei	hypothetical protein, conserved	0.0552	0.2987	0.5
Loa Loa (eye worm)	sex muscle abnormal protein 5	0.0062	0.0152	0.0118
Entamoeba histolytica	protein kinase, putative	0.0073	0.0218	1
Onchocerca volvulus		0.1552	0.8769	1
Echinococcus multilocularis	tyrosine kinase	0.0044	0.0049	0.0049
Schistosoma mansoni	growth factor receptor-bound protein	0.0062	0.0152	0.0123
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0135	0.0576	0.0529
Trypanosoma cruzi	WLM domain containing protein, putative	0.0552	0.2987	0.5
Schistosoma mansoni	fusion	0.0552	0.2987	0.3373
Schistosoma mansoni	tyrosine kinase	0.0044	0.0049	0.0005
Echinococcus granulosus	SWI:SNF matrix associated	0.1552	0.8769	0.8763
Loa Loa (eye worm)	TK/INSR protein kinase	0.0283	0.1429	0.1582
Echinococcus multilocularis	tyrosine protein kinase Fps85D	0.0044	0.0049	0.0049
Echinococcus multilocularis	ring and YY1 binding protein	0.0552	0.2987	0.2987
Trypanosoma cruzi	mitochondrial RNA binding complex 1 subunit, putative	0.0552	0.2987	0.5
Echinococcus multilocularis	SWI:SNF matrix associated	0.1552	0.8769	0.8769
Schistosoma mansoni	tyrosine kinase	0.0075	0.0225	0.0207
Brugia malayi	Furin-like cysteine rich region family protein	0.0134	0.0571	0.0599
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0325	0.1675	0.1864
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0135	0.0576	0.0576
Brugia malayi	SRC-1	0.0135	0.0576	0.0604
Toxoplasma gondii	DNA topoisomerase domain-containing protein	0.1552	0.8769	1
Loa Loa (eye worm)	TK protein kinase	0.0105	0.0399	0.0402
Trypanosoma cruzi	WLM domain containing protein, putative	0.0552	0.2987	0.5
Onchocerca volvulus		0.0552	0.2987	0.3369
Brugia malayi	Zn-finger in Ran binding protein and others containing protein	0.0552	0.2987	0.3369
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0135	0.0576	0.0529

Activities

Activity type	Activity value	Assay description	Source	Reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the K-562 Leukemia cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-5	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory)	ChEMBL.	No reference

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: CHEMBL1964942

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 1620585