TDR Targets

Basic information

Technical information

TDR Targets ID: 613449
Name: 3,4-diethoxy-N-[2-(2-methylphenyl)-4,6-dihydr othieno[3,4-d]pyrazol-3-yl]benzamide
MW: 423.528 | Formula: C23H25N3O3S
H donors: 1 H acceptors: 2 LogP: 4.16 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCOc1cc(ccc1OCC)C(=O)Nc1c2CSCc2nn1c1ccccc1C
InChi: 1S/C23H25N3O3S/c1-4-28-20-11-10-16(12-21(20)29-5-2)23(27)24-22-17-13-30-14-18(17)25-26(22)19-9-7-6-8-15(19)3/h6-12H,4-5,13-14H2,1-3H3,(H,24,27)
InChiKey: SZPKMGMXKBERHB-UHFFFAOYSA-N

Network

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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

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Clustering layers

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Synonyms

Oprea1_712379
ZINC04087577
EU-0062161

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
Trypanosoma cruzi	hexose transporter, putative	0.0036	0.0333	0.4527
Trypanosoma cruzi	hexose transporter, putative	0.0036	0.0333	0.4527
Trypanosoma cruzi	hexose transporter	0.0036	0.0333	0.4527
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.004	0.0411	0.5584
Echinococcus multilocularis	jumonji domain containing protein	0.0254	0.409	0.409
Plasmodium vivax	hypothetical protein, conserved	0.0183	0.2861	0.3546
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0026	0.0162	0.3046
Schistosoma mansoni	lysyl-tRNA synthetase	0.0026	0.0162	0.0206
Trypanosoma brucei	PHD-zinc-finger like domain containing protein, putative	0.006	0.0749	1
Giardia lamblia	PHD finger protein 15	0.0183	0.2861	1
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0333	0.445
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0022	0.0096	1
Plasmodium vivax	hexose transporter	0.0115	0.169	0.2094
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0026	0.0162	1
Schistosoma mansoni	ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related	0.0059	0.0736	0.0933
Brugia malayi	jmjC domain containing protein	0.0221	0.3521	0.3521
Loa Loa (eye worm)	hypothetical protein	0.006	0.0749	0.1208
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0599	1	1
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0333	0.445
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0034	0.0313	0.0397
Schistosoma mansoni	hypothetical protein	0.0183	0.2861	0.3627
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0016	0	0.5
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0059	0.0736	0.0736
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0035	0.0326	0.0326
Echinococcus granulosus	lysine specific demethylase 5A	0.0221	0.3521	0.3521
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0333	0.445
Entamoeba histolytica	protein kinase, putative	0.0035	0.0326	1
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0034	0.0313	0.0313
Schistosoma mansoni	protein kinase	0.0035	0.0326	0.0413
Echinococcus granulosus	lysine specific demethylase 6a	0.0059	0.0736	0.0736
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0115	0.169	0.169
Trichomonas vaginalis	sugar transporter, putative	0.0036	0.0333	0.1973
Plasmodium falciparum	hexose transporter	0.0115	0.169	0.2094
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0035	0.0326	0.0617
Chlamydia trachomatis	lysine--tRNA ligase	0.0026	0.0162	0.5
Plasmodium vivax	hypothetical protein, conserved	0.006	0.0749	0.0928
Toxoplasma gondii	PHD-finger domain-containing protein	0.0183	0.2861	0.542
Schistosoma mansoni	protein phosphatase 2C	0.0059	0.0736	0.0933
Schistosoma mansoni	glucose transport protein	0.0115	0.169	0.2142
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0736	0.1187
Loa Loa (eye worm)	jmjC domain-containing protein	0.0378	0.6202	1
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0035	0.0326	0.0525
Echinococcus multilocularis	General substrate transporter	0.0098	0.1413	0.1413
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0034	0.0313	0.0313
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0115	0.169	0.169
Leishmania major	lysyl-tRNA synthetase, putative	0.0026	0.0162	0.2206
Giardia lamblia	Prolyl-tRNA synthetase	0.0034	0.0313	0.1095
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0333	0.445
Entamoeba histolytica	protein kinase, putative	0.0035	0.0326	1
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0035	0.0326	0.0404
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0333	0.445
Leishmania major	glucose transporter, lmgt3	0.0036	0.0333	0.4527
Brugia malayi	Cam kinase protein 1	0.0035	0.0326	0.0326
Loa Loa (eye worm)	PHD-finger family protein	0.0183	0.2861	0.4613
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.004	0.0411	0.5584
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0203	0.0327
Schistosoma mansoni	protein kinase	0.0035	0.0326	0.0413
Echinococcus granulosus	phd:f box containing protein	0.0059	0.0736	0.0736
Giardia lamblia	Lysyl-tRNA synthetase	0.0026	0.0162	0.0568
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0736	0.1187
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0036	0.0333	0.445
Onchocerca volvulus	Alhambra homolog	0.0183	0.2861	1
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0736	0.1187
Brugia malayi	jmjC domain containing protein	0.0059	0.0736	0.0736
Trichomonas vaginalis	sugar transporter, putative	0.0036	0.0333	0.1973
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0035	0.0326	0.0617
Trichomonas vaginalis	glucose transporter, putative	0.0036	0.0333	0.1973
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0313	0.0505
Toxoplasma gondii	histone lysine demethylase JMJC1/KDM5D/JARID1D	0.0059	0.0736	0.1395
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.004	0.0411	0.0779
Schistosoma mansoni	jumonji domain containing protein	0.0059	0.0736	0.0933
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0034	0.0313	0.1855
Echinococcus multilocularis	lysyl tRNA synthetase	0.0026	0.0162	0.0162
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0035	0.0326	0.4347
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0035	0.0326	0.0404
Plasmodium falciparum	conserved Plasmodium membrane protein, unknown function	0.006	0.0749	0.0928
Trypanosoma cruzi	hexose transporter, putative	0.0036	0.0333	0.4527
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0026	0.0162	0.0961
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0034	0.0313	0.0313
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0411	0.5584
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0026	0.0162	0.2206
Loa Loa (eye worm)	jmjC domain-containing protein	0.0221	0.3521	0.5678
Trypanosoma cruzi	JmjC domain, hydroxylase, putative	0.0059	0.0736	1
Echinococcus multilocularis	lysine specific demethylase 6a	0.0059	0.0736	0.0736
Trichomonas vaginalis	sugar transporter, putative	0.0036	0.0333	0.1973
Brugia malayi	jmjC domain containing protein	0.0059	0.0736	0.0736
Trichomonas vaginalis	CAMK family protein kinase	0.0035	0.0326	0.1927
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0026	0.0162	1
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0035	0.0326	0.0326
Schistosoma mansoni	glucose transport protein	0.0115	0.169	0.2142
Trypanosoma brucei	glucose transporter 2A	0.0036	0.0333	0.445
Leishmania major	protein kinase, putative	0.0035	0.0326	0.4422
Brugia malayi	PHD-finger family protein	0.006	0.0749	0.0749
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0035	0.0326	0.0326
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0115	0.169	0.169
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0411	0.5584
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0035	0.0326	0.0326
Trichomonas vaginalis	conserved hypothetical protein	0.0115	0.169	1
Brugia malayi	lysyl-tRNA synthetase	0.0026	0.0162	0.0162
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0162	0.0262
Plasmodium falciparum	lysine--tRNA ligase	0.0026	0.0162	0.0201
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0035	0.0326	0.0326
Schistosoma mansoni	hypothetical protein	0.006	0.0749	0.095
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0026	0.0162	0.2168
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0115	0.169	0.169
Loa Loa (eye worm)	hypothetical protein	0.0314	0.5103	0.8227
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0185	0.2901	0.5495
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0115	0.169	0.169
Echinococcus granulosus	calcium dependent protein kinase	0.0033	0.0288	0.0288
Brugia malayi	F/Y-rich N-terminus family protein	0.006	0.0749	0.0749
Echinococcus granulosus	jumonji domain containing protein	0.0254	0.409	0.409
Brugia malayi	PHD-finger family protein	0.0183	0.2861	0.2861
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0035	0.0326	0.0326
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0035	0.0326	0.0617
Schistosoma mansoni	glucose transport protein	0.0115	0.169	0.2142
Schistosoma mansoni	lysyl-tRNA synthetase	0.0026	0.0162	0.0206
Echinococcus granulosus	General substrate transporter	0.0098	0.1413	0.1413
Toxoplasma gondii	facilitative glucose transporter GT1	0.0115	0.169	0.3201
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0599	1	1
Plasmodium falciparum	protein kinase 7	0.0324	0.5279	0.6542
Trypanosoma cruzi	JmjC domain, hydroxylase, putative	0.0059	0.0736	1
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0022	0.0096	1
Schistosoma mansoni	jumonji domain containing protein	0.0476	0.7888	1
Plasmodium vivax	lysine--tRNA ligase, putative	0.0026	0.0162	0.0201
Plasmodium falciparum	JmjC domain-containing protein, putative	0.0059	0.0736	0.0913
Echinococcus granulosus	peregrin	0.0183	0.2861	0.2861
Echinococcus multilocularis	lysine specific demethylase 5A	0.0221	0.3521	0.3521
Trichomonas vaginalis	conserved hypothetical protein	0.0036	0.0333	0.1973
Brugia malayi	AF-10 protein	0.006	0.0749	0.0749
Loa Loa (eye worm)	hypothetical protein	0.0183	0.2861	0.4613
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0022	0.0108	0.0641
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0035	0.0326	0.0404
Leishmania major	glucose transporter, lmgt1	0.0036	0.0333	0.4527
Trypanosoma cruzi	hexose transporter, putative	0.0019	0.0057	0.0772
Echinococcus multilocularis	peregrin	0.0183	0.2861	0.2861
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0326	0.0525
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0035	0.0326	0.0404
Echinococcus multilocularis	calcium dependent protein kinase	0.0033	0.0288	0.0288
Leishmania major	glucose transporter, lmgt2	0.0036	0.0333	0.4527
Schistosoma mansoni	phd/f-box containing protein	0.0059	0.0736	0.0933
Toxoplasma gondii	lysine-tRNA ligase	0.0026	0.0162	0.0308
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0333	0.445
Echinococcus granulosus	jumonji domain containing 1A	0.0059	0.0736	0.0736
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0035	0.0326	0.0326
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0034	0.0313	0.9253
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0221	0.3521	0.4464
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0035	0.0326	0.0404
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0736	0.1187
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.0749	0.095
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0221	0.3521	0.4464
Echinococcus granulosus	JmjC domain containing protein 4	0.0059	0.0736	0.0736
Echinococcus multilocularis	jumonji domain containing 1A	0.0059	0.0736	0.0736
Plasmodium falciparum	protein kinase 6	0.0486	0.8069	1
Trypanosoma brucei	PHD-zinc-finger like domain containing protein, putative	0.006	0.0749	1
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0333	0.445
Echinococcus granulosus	lysyl tRNA synthetase	0.0026	0.0162	0.0162
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0035	0.0326	0.0326
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0035	0.0326	0.0404
Schistosoma mansoni	hypothetical protein	0.0115	0.169	0.2142
Schistosoma mansoni	protein kinase	0.0035	0.0326	0.0413
Trypanosoma brucei	JmjC domain, hydroxylase, putative	0.0059	0.0736	0.983
Schistosoma mansoni	phosphatidylserine receptor	0.0059	0.0736	0.0933
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0034	0.0313	0.0397
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0035	0.0326	0.0404
Plasmodium vivax	proline--tRNA ligase, putative	0.004	0.0411	0.051
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0185	0.2901	0.3595
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0115	0.169	0.169
Toxoplasma gondii	protein kinase, putative	0.0324	0.5279	1
Trypanosoma brucei	glucose transporter, putative	0.0036	0.0333	0.445
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0035	0.0326	0.0404
Loa Loa (eye worm)	sugar transporter	0.0115	0.169	0.2724
Brugia malayi	Sugar transporter family protein	0.0115	0.169	0.169
Brugia malayi	jmjC domain containing protein	0.0059	0.0736	0.0736
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0115	0.169	0.169
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0486	0.8069	1
Toxoplasma gondii	PHD-finger domain-containing protein	0.0183	0.2861	0.542
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0185	0.2901	0.3595
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0313	0.0505
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0034	0.0313	1
Echinococcus multilocularis	phd:f box containing protein	0.0059	0.0736	0.0736
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0036	0.0333	0.4527
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0035	0.0326	0.0525
Trichomonas vaginalis	glucose transporter, putative	0.0036	0.0333	0.1973
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0034	0.0313	0.0313
Echinococcus granulosus	PHD finger protein rhinoceros	0.0183	0.2861	0.2861
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0035	0.0326	0.0404
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.0183	0.2861	0.3627
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0736	0.1187
Schistosoma mansoni	serine/threonine protein kinase	0.0035	0.0326	0.0413
Brugia malayi	jmjC domain containing protein	0.0059	0.0736	0.0736
Toxoplasma gondii	histone lysine demethylase JMJD6a	0.0059	0.0736	0.1395
Brugia malayi	Bromodomain containing protein	0.0183	0.2861	0.2861
Plasmodium vivax	JmjC domain containing protein	0.0059	0.0736	0.0913
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0035	0.0326	0.0326
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0115	0.169	0.169
Trypanosoma brucei	glucose transporter 1E	0.0036	0.0333	0.445
Leishmania major	hypothetical protein, conserved	0.0059	0.0736	1
Echinococcus multilocularis	JmjC domain containing protein 4	0.0059	0.0736	0.0736
Toxoplasma gondii	PHD-finger domain-containing protein	0.006	0.0749	0.1419
Plasmodium falciparum	phd finger protein, putative	0.0183	0.2861	0.3546
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.004	0.0411	0.5489
Echinococcus multilocularis	PHD finger protein rhinoceros	0.0183	0.2861	0.2861
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0036	0.0333	0.445
Toxoplasma gondii	WD domain, G-beta repeat-containing protein	0.006	0.0749	0.1419
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0036	0.0333	0.445
Plasmodium falciparum	proline--tRNA ligase	0.004	0.0411	0.051
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0059	0.0736	0.0736
Trichomonas vaginalis	conserved hypothetical protein	0.0036	0.0333	0.1973

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 613449