TDR Targets

Basic information

Technical information

TDR Targets ID: 687345
Name: 1-[6-(4-methylphenyl)-7-propanoyl-[1,2,4]tria zolo[3,4-b][1,3,4]thiadiazin-5-yl]propan-1-on e
MW: 342.415 | Formula: C17H18N4O2S
H donors: 0 H acceptors: 4 LogP: 3.74 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CCC(=O)c1sc2nncn2n(c1c1ccc(cc1)C)C(=O)CC
InChi: 1S/C17H18N4O2S/c1-4-13(22)16-15(12-8-6-11(3)7-9-12)21(14(23)5-2)20-10-18-19-17(20)24-16/h6-10H,4-5H2,1-3H3
InChiKey: VHZDAXBAAGREAN-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

1-[6-(4-methylphenyl)-7-(1-oxopropyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]propan-1-one
1-[6-(4-methylphenyl)-7-propionyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-5-yl]propan-1-one
ZINC04518218

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	cadherin EGF LAG seven pass G type receptor	0.0034	0.0606	0.1426
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0877	0.0516
Schistosoma mansoni	transcription factor LCR-F1	0.0068	0.1499	0.1465
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0034	0.0606	0.0855
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0034	0.0606	0.1426
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0683	0.0219
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0099	0.2306	0.5423
Echinococcus granulosus	beta LACTamase domain containing family member	0.0037	0.0683	0.1606
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.0877	0.2062
Schistosoma mansoni	high voltage-activated calcium channel Cav1	0.0099	0.2306	0.2696
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0683	0.0962
Schistosoma mansoni	hypothetical protein	0.0074	0.1646	0.1689
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0877	0.0516
Leishmania major	hypothetical protein, conserved	0.0037	0.0683	1
Loa Loa (eye worm)	hypothetical protein	0.0068	0.1493	0.2104
Loa Loa (eye worm)	transcription factor SMAD2	0.0122	0.291	0.4102
Schistosoma mansoni	tar DNA-binding protein	0.0072	0.1611	0.1636
Loa Loa (eye worm)	RNA binding protein	0.0072	0.1611	0.2271
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0068	0.1499	0.3526
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0108	0.2542	0.3584
Loa Loa (eye worm)	glutaminase 2	0.0281	0.7094	1
Schistosoma mansoni	amyloid beta A4 protein related	0.0071	0.1565	0.1566
Echinococcus granulosus	voltage dependent calcium channel	0.0021	0.0254	0.0597
Loa Loa (eye worm)	hypothetical protein	0.0108	0.2542	0.3584
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0108	0.2542	0.3584
Loa Loa (eye worm)	hypothetical protein	0.0074	0.1646	0.2321
Entamoeba histolytica	hypothetical protein	0.0068	0.1499	1
Schistosoma mansoni	voltage-gated cation channel	0.0099	0.2306	0.2696
Loa Loa (eye worm)	glutaminase	0.0281	0.7094	1
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0606	0.0855
Loa Loa (eye worm)	SMO-1 protein	0.0031	0.0539	0.0759
Toxoplasma gondii	transporter, cation channel family protein	0.0021	0.0254	0.0067
Entamoeba histolytica	hypothetical protein	0.0068	0.1499	1
Schistosoma mansoni	hypothetical protein	0.0034	0.0606	0.0103
Echinococcus granulosus	amyloid beta A4 protein	0.0071	0.1565	0.3682
Entamoeba histolytica	hypothetical protein	0.0068	0.1499	1
Brugia malayi	hypothetical protein	0.0068	0.1493	0.2104
Schistosoma mansoni	high voltage-activated calcium channel Cav2A	0.0099	0.2306	0.2696
Brugia malayi	RNA binding protein	0.0072	0.1611	0.2271
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0037	0.0683	0.1606
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0034	0.0606	0.1426
Echinococcus multilocularis	GPCR, family 2	0.0034	0.0606	0.1426
Brugia malayi	MH2 domain containing protein	0.0122	0.291	0.4102
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0683	0.0962
Toxoplasma gondii	small ubiquitin family modifier, putative	0.0031	0.0539	0.0357
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.0877	0.2062
Schistosoma mansoni	tar DNA-binding protein	0.0072	0.1611	0.1636
Mycobacterium leprae	PROBABLE NICOTINATE-NUCLEOTIDE ADENYLYLTRANSFERASE NADD (DEAMIDO-NAD(+) PYROPHOSPHORYLASE) (DEAMIDO-NAD(+) DIPHOSPHORYLASE) (NIC	0.0246	0.6193	1
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel\|voltage dependent L type calcium channel subu	0.0099	0.2306	0.5423
Echinococcus multilocularis	Small ubiquitin modifier 2	0.0031	0.0539	0.1267
Loa Loa (eye worm)	MH2 domain-containing protein	0.0122	0.291	0.4102
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0683	0.1917
Schistosoma mansoni	glutaminase	0.0281	0.7094	1
Echinococcus multilocularis	voltage dependent calcium channel	0.0099	0.2306	0.5423
Echinococcus granulosus	tar DNA binding protein	0.0072	0.1611	0.3789
Entamoeba histolytica	hypothetical protein	0.0068	0.1499	1
Onchocerca volvulus		0.0037	0.0683	1
Onchocerca volvulus		0.0037	0.0683	1
Echinococcus granulosus	voltage dependent calcium channel type d subunit\|voltage dependent calcium channel alpha 1	0.0099	0.2306	0.5423
Loa Loa (eye worm)	X11 protein	0.0071	0.1565	0.2207
Schistosoma mansoni	tar DNA-binding protein	0.0072	0.1611	0.1636
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0683	0.0962
Echinococcus granulosus	voltage dependent L type calcium channel subunit\|voltage dependent calcium channel	0.0099	0.2306	0.5423
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0108	0.2542	0.3584
Brugia malayi	glutaminase DH11.1	0.0281	0.7094	1
Mycobacterium ulcerans	glutaminase	0.0281	0.7094	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0068	0.1499	0.3526
Trichomonas vaginalis	glutaminase, putative	0.0281	0.7094	1
Mycobacterium ulcerans	bifunctional nicotinate-nucleotide adenylyltransferase NadD/hypothetical protein	0.0246	0.6193	0.8594
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0034	0.0606	0.0855
Plasmodium vivax	nicotinate-nucleotide adenylyltransferase, putative	0.0246	0.6193	1
Brugia malayi	beta-lactamase	0.0037	0.0683	0.0962
Brugia malayi	Ubiquitin-like protein SMT3	0.0031	0.0539	0.0759
Echinococcus granulosus	GPCR family 2	0.0034	0.0606	0.1426
Echinococcus granulosus	geminin	0.0173	0.4252	1
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0099	0.2306	0.5423
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0037	0.0683	0.0962
Brugia malayi	beta-lactamase family protein	0.0037	0.0683	0.0962
Brugia malayi	Latrophilin receptor protein 2	0.0034	0.0606	0.0855
Echinococcus multilocularis	voltage dependent calcium channel	0.0099	0.2306	0.5423
Echinococcus multilocularis	geminin	0.0173	0.4252	1
Onchocerca volvulus		0.0037	0.0683	1
Trypanosoma brucei	hypothetical protein, conserved	0.0037	0.0683	0.1917
Mycobacterium tuberculosis	Probable nicotinate-nucleotide adenylyltransferase NadD (deamido-NAD(+) pyrophosphorylase) (deamido-NAD(+) diphosphorylase) (nic	0.0246	0.6193	1
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.0683	0.0254
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0044	0.0877	0.1236
Echinococcus multilocularis	amyloid beta A4 protein	0.0071	0.1565	0.3682
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0188	0.0265
Loa Loa (eye worm)	beta-lactamase	0.0037	0.0683	0.0962
Trypanosoma cruzi	Voltage-dependent calcium channel subunit, putative	0.006	0.1289	1
Echinococcus multilocularis	tar DNA binding protein	0.0072	0.1611	0.3789
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0683	0.0962
Schistosoma mansoni	hypothetical protein	0.0034	0.0606	0.0103
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0683	0.0962
Plasmodium falciparum	nicotinamide/nicotinic acid mononucleotide adenylyltransferase	0.0246	0.6193	1
Entamoeba histolytica	ubiquitin like protein	0.0031	0.0539	0.3594
Brugia malayi	Voltage-gated calcium channel, L-type, alpha subunit. C. elegans egl-19 ortholog	0.0099	0.2306	0.325
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0683	0.0962
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0188	0.0265
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0034	0.0606	0.1426
Loa Loa (eye worm)	hypothetical protein	0.0099	0.2306	0.325
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0044	0.0877	0.1236
Brugia malayi	TAR-binding protein	0.0072	0.1611	0.2271
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0042	0.0811	0.1908
Echinococcus multilocularis	sodium channel protein	0.0042	0.0811	0.1908
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0683	0.0962
Schistosoma mansoni	hypothetical protein	0.0034	0.0606	0.0103
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0236	0.5923	0.9511
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0037	0.0683	0.0962
Brugia malayi	latrophilin 2 splice variant baaae	0.0074	0.1646	0.2321
Treponema pallidum	hypothetical protein	0.0246	0.6193	0.5
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0683	0.0962
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0683	0.1917
Schistosoma mansoni	hypothetical protein	0.0173	0.4252	0.5664
Schistosoma mansoni	tar DNA-binding protein	0.0072	0.1611	0.1636
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0683	0.0962
Echinococcus granulosus	Small ubiquitin modifier 2	0.0031	0.0539	0.1267
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.0877	0.2062
Echinococcus multilocularis	voltage dependent calcium channel type d subunit	0.0099	0.2306	0.5423
Brugia malayi	RNA recognition motif domain containing protein	0.0072	0.1611	0.2271
Schistosoma mansoni	hypothetical protein	0.0068	0.1499	0.1465
Loa Loa (eye worm)	TAR-binding protein	0.0072	0.1611	0.2271
Echinococcus granulosus	voltage dependent calcium channel	0.0099	0.2306	0.5423
Trypanosoma brucei	Voltage-dependent calcium channel subunit, putative	0.006	0.1289	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0254	0.0358
Brugia malayi	beta-lactamase family protein	0.0037	0.0683	0.0962
Trichomonas vaginalis	esterase, putative	0.0037	0.0683	0.0962
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0877	0.0516
Toxoplasma gondii	ABC1 family protein	0.0037	0.0683	0.0504
Echinococcus multilocularis	voltage dependent L type calcium channel subunit	0.0099	0.2306	0.5423
Schistosoma mansoni	hypothetical protein	0.0034	0.0606	0.0103
Trichomonas vaginalis	conserved hypothetical protein	0.0031	0.0539	0.0759
Brugia malayi	hypothetical protein	0.0068	0.1499	0.2113
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0683	0.0962
Loa Loa (eye worm)	voltage-dependent calcium channel	0.0021	0.0254	0.0358
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.0877	0.2062
Schistosoma mansoni	tar DNA-binding protein	0.0072	0.1611	0.1636
Brugia malayi	abnormal cell lineage protein 10 (Protein lin-10), putative	0.0063	0.137	0.1931
Giardia lamblia	Sentrin	0.0031	0.0539	0.5
Schistosoma mansoni	hypothetical protein	0.0173	0.4252	0.5664
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0072	0.1611	0.2271
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0683	0.0962
Loa Loa (eye worm)	calcium channel	0.0099	0.2306	0.325
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0683	0.0219

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 687345