TDR Targets

Basic information

Technical information

TDR Targets ID: 617604
Name: N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[5,4 -c]pyridin-2-yl)-2-methylbenzamide
MW: 339.411 | Formula: C18H17N3O2S
H donors: 1 H acceptors: 3 LogP: 2.77 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: N#Cc1c(sc2c1CCN(C2)C(=O)C)NC(=O)c1ccccc1C
InChi: 1S/C18H17N3O2S/c1-11-5-3-4-6-13(11)17(23)20-18-15(9-19)14-7-8-21(12(2)22)10-16(14)24-18/h3-6H,7-8,10H2,1-2H3,(H,20,23)
InChiKey: CVYWBAPMWDMTCL-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-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[5,4-c]pyridin-2-yl)-2-methyl-benzamide
N-(3-cyano-6-ethanoyl-5,7-dihydro-4H-thieno[5,4-c]pyridin-2-yl)-2-methyl-benzamide
ZINC04275245

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
Brugia malayi	PHD-finger family protein	0.006	0.0296	0.1103
Trichomonas vaginalis	chromobox protein, putative	0.0073	0.0443	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0144	0.129	0.1024
Schistosoma mansoni	tar DNA-binding protein	0.0261	0.2682	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0052	0.0196	0.0732
Loa Loa (eye worm)	TAR-binding protein	0.0261	0.2682	1
Toxoplasma gondii	PHD-finger domain-containing protein	0.006	0.0296	0.5
Brugia malayi	chromobox protein homolog 3	0.0041	0.0062	0.0231
Loa Loa (eye worm)	PHD-finger family protein	0.006	0.0296	0.1103
Onchocerca volvulus	Alhambra homolog	0.006	0.0296	1
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0198	0.1934	0.1688
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0073	0.0447	0.1667
Echinococcus multilocularis	jumonji domain containing protein	0.0084	0.0578	0.0291
Echinococcus multilocularis	tar DNA binding protein	0.0261	0.2682	0.2459
Loa Loa (eye worm)	jmjC domain-containing protein	0.0073	0.0447	0.1667
Echinococcus multilocularis	chromobox protein 1	0.0073	0.0443	0.0152
Trichomonas vaginalis	chromobox protein, putative	0.0044	0.0099	0.0969
Plasmodium falciparum	phd finger protein, putative	0.006	0.0296	0.5
Schistosoma mansoni	hypothetical protein	0.006	0.0296	0.1103
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0044	0.0099	0.1579
Schistosoma mansoni	tar DNA-binding protein	0.0261	0.2682	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0144	0.129	0.4809
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0144	0.129	0.4809
Brugia malayi	RNA recognition motif domain containing protein	0.0261	0.2682	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0144	0.129	0.4165
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0073	0.0447	0.1667
Giardia lamblia	PHD finger protein 15	0.006	0.0296	0.5
Brugia malayi	jmjC domain containing protein	0.0198	0.1934	0.721
Brugia malayi	Bromodomain containing protein	0.006	0.0296	0.1103
Echinococcus granulosus	lysine specific demethylase 5A	0.0073	0.0447	0.0635
Loa Loa (eye worm)	RNA binding protein	0.0261	0.2682	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0144	0.129	0.4165
Brugia malayi	jmjC domain containing protein	0.0073	0.0447	0.1667
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0144	0.129	0.4809
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0052	0.0196	0.0732
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0144	0.129	0.1024
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0198	0.1934	0.6864
Loa Loa (eye worm)	hypothetical protein	0.006	0.0296	0.1103
Brugia malayi	TAR-binding protein	0.0261	0.2682	1
Echinococcus granulosus	chromobox protein 1	0.0073	0.0443	0.0618
Echinococcus granulosus	jumonji domain containing protein	0.0084	0.0578	0.1182
Echinococcus multilocularis	lysine specific demethylase 5A	0.0073	0.0447	0.0156
Toxoplasma gondii	PHD-finger domain-containing protein	0.006	0.0296	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0261	0.2682	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0144	0.129	0.4809
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0261	0.2682	1
Loa Loa (eye worm)	jmjC domain-containing protein	0.0125	0.1062	0.3961
Echinococcus granulosus	chromobox protein 1	0.0073	0.0443	0.0618
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0196	0.0732
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0062	0.0231
Trichomonas vaginalis	chromobox protein, putative	0.0044	0.0099	0.0969
Echinococcus granulosus	tar DNA binding protein	0.0261	0.2682	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0052	0.0196	0.0732
Brugia malayi	Heterochromatin protein 1	0.0073	0.0443	0.1652
Trichomonas vaginalis	chromobox protein, putative	0.0073	0.0443	1
Loa Loa (eye worm)	hypothetical protein	0.0104	0.081	0.302
Brugia malayi	RNA binding protein	0.0261	0.2682	1
Schistosoma mansoni	tar DNA-binding protein	0.0261	0.2682	1
Schistosoma mansoni	chromobox protein	0.0073	0.0443	0.1652
Loa Loa (eye worm)	heterochromatin protein 1	0.0073	0.0443	0.1652
Plasmodium vivax	hypothetical protein, conserved	0.006	0.0296	0.5
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.006	0.0296	0.1103
Schistosoma mansoni	chromobox protein	0.0073	0.0443	0.1652
Schistosoma mansoni	jumonji domain containing protein	0.0157	0.1449	0.5403
Schistosoma mansoni	tar DNA-binding protein	0.0261	0.2682	1
Echinococcus multilocularis	chromobox protein 1	0.0073	0.0443	0.0152
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0144	0.129	0.4809

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 617604