TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 366.453 | Formula: C22H26N2O3
H donors: 1 H acceptors: 2 LogP: 4.34 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CC1Oc2c(C1)c(C)c(cc2)C(=O)NN(C(C)(C)C)C(=O)c1ccccc1
InChi: 1S/C22H26N2O3/c1-14-13-18-15(2)17(11-12-19(18)27-14)20(25)23-24(22(3,4)5)21(26)16-9-7-6-8-10-16/h6-12,14H,13H2,1-5H3,(H,23,25)
InChiKey: ROIOXYBSWGBGRF-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

No synonyms found for this compound

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
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine protein kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	serine/threonine RGC	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine-protein kinase fps85d	0.0364	0.0127	0.0127
Schistosoma mansoni	serine/threonine protein kinase	0.0364	0.0127	0.0127
Loa Loa (eye worm)	hypothetical protein	0.124	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Entamoeba histolytica	hypothetical protein	0.0405	0.0587	1
Trichomonas vaginalis	STE family protein kinase	0.0364	0.0127	0.5
Plasmodium falciparum	protein kinase, putative	0.0364	0.0127	0.5
Schistosoma mansoni	protein tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0573	0.2479	0.2479
Giardia lamblia	Kinase, NEK	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Trypanosoma brucei	serine peptidase, Clan SC, Family S10	0.124	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Loa Loa (eye worm)	TK protein kinase	0.0373	0.0227	0.0101
Trichomonas vaginalis	serine-threonine protein kinase, putative	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Echinococcus granulosus	insulin receptor	0.0573	0.2479	0.2382
Trichomonas vaginalis	br serine/threonine-protein kinase, putative	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trypanosoma brucei	serine peptidase, Clan SC, Family S10	0.124	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Echinococcus granulosus	epidermal growth factor receptor	0.0718	0.411	0.4034
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Echinococcus granulosus	lysosomal protective protein	0.124	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Plasmodium falciparum	tyrosine kinase-like protein	0.0364	0.0127	0.5
Schistosoma mansoni	src-type protein tyrosine kinase-related	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.0364	0.0127	0.0127
Toxoplasma gondii	protein kinase domain-containing protein	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Entamoeba histolytica	hypothetical protein	0.0405	0.0587	1
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	protein kinase atn1, putative	0.0364	0.0127	0.5
Toxoplasma gondii	protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Plasmodium falciparum	tyrosine kinase-like protein	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine protein kinase fes (fps) (ptk group IV)	0.0364	0.0127	0.0127
Echinococcus multilocularis	family S10 non peptidase ue (S10 family)	0.1118	0.8618	0.86
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Brugia malayi	Protein kinase domain containing protein	0.0573	0.2479	0.2382
Schistosoma mansoni	hypothetical protein	0.0364	0.0127	0.0127
Trichomonas vaginalis	AGC family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	family S10 non-peptidase homologue (S10 family)	0.124	1	1
Loa Loa (eye worm)	TK/EGFR protein kinase	0.1025	0.7576	0.7545
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0364	0.0127	0.5
Plasmodium falciparum	protein kinase, putative	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0573	0.2479	0.2382
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0364	0.0127	0.5
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Echinococcus granulosus	tyrosine protein kinase transmembrane receptor	0.0373	0.0227	0.0101
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0364	0.0127	0.5
Giardia lamblia	Kinase, NEK	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Onchocerca volvulus	Tyrosine kinase homolog	0.0373	0.0227	0.0101
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Echinococcus multilocularis	epidermal growth factor receptor	0.1025	0.7576	0.7545
Trichomonas vaginalis	protein tyrosine kinase, putative	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0718	0.411	0.411
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0364	0.0127	0.5
Trypanosoma cruzi	serine peptidase, Clan SC, Family S10, putative	0.124	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.1025	0.7576	0.7576
Toxoplasma gondii	STE kinase	0.0364	0.0127	0.5
Loa Loa (eye worm)	TK/ROR protein kinase	0.0373	0.0227	0.0101
Schistosoma mansoni	tyrosine kinase	0.0718	0.411	0.411
Entamoeba histolytica	leucine-rich repeat domain-containing protein	0.0405	0.0587	1
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trypanosoma cruzi	serine carboxypeptidase (CBP1), putative	0.124	1	1
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	ephrin receptor	0.0364	0.0127	0.0127
Toxoplasma gondii	calcium dependent protein kinase CDPK8	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0364	0.0127	0.0127
Plasmodium falciparum	protein kinase, putative	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TK family protein kinase	0.0364	0.0127	0.5
Echinococcus multilocularis	insulin receptor	0.0573	0.2479	0.2382
Trichomonas vaginalis	conserved hypothetical protein	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0573	0.2479	0.2382
Trichomonas vaginalis	conserved hypothetical protein	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0373	0.0227	0.0227
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine protein kinase fes (fps) (ptk group IV)	0.0364	0.0127	0.0127
Trichomonas vaginalis	serine/threonine-protein kinase wnk, putative	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trypanosoma cruzi	serine carboxypeptidase (CBP1), putative	0.124	1	1
Entamoeba histolytica	hypothetical protein	0.0405	0.0587	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0373	0.0227	0.0101
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.0364	0.0127	0.0127
Loa Loa (eye worm)	TK/INSR protein kinase	0.0573	0.2479	0.2382
Trichomonas vaginalis	conserved hypothetical protein	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Echinococcus multilocularis	tyrosine protein kinase transmembrane receptor	0.0373	0.0227	0.0101
Echinococcus multilocularis	lysosomal protective protein	0.124	1	1
Echinococcus multilocularis	epidermal growth factor receptor	0.0718	0.411	0.4034
Entamoeba histolytica	protein kinase, putative	0.0405	0.0587	1
Trichomonas vaginalis	CAMK family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trypanosoma cruzi	serine peptidase, Clan SC, Family S10, putative	0.124	1	1
Leishmania major	serine carboxypeptidase (CBP1), putative,serine peptidase, Clan SC, Family S10	0.124	1	1
Schistosoma mansoni	family S10 unassigned peptidase (S10 family)	0.124	1	1
Schistosoma mansoni	ephrin receptor	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trypanosoma brucei	serine peptidase, Clan SC, Family S10	0.124	1	1
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	serine/threonine protein kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Echinococcus granulosus	family S10 non peptidase ue S10 family	0.1118	0.8618	0.86
Echinococcus granulosus	melanoma receptor tyrosine protein kinase	0.0718	0.411	0.4034
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Giardia lamblia	Kinase	0.0364	0.0127	0.5
Giardia lamblia	Protein 21.1	0.0364	0.0127	0.5
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	protein kinase	0.0364	0.0127	0.0127
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine-protein kinase fps85d	0.0364	0.0127	0.0127
Trichomonas vaginalis	conserved hypothetical protein	0.0364	0.0127	0.5
Plasmodium vivax	protein kinase, putative	0.0364	0.0127	0.5
Brugia malayi	Furin-like cysteine rich region family protein	0.1025	0.7576	0.7545
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0364	0.0127	0.5
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0573	0.2479	0.2479
Onchocerca volvulus	Uncharacterized serine carboxypeptidase homolog	0.124	1	1
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Schistosoma mansoni	tyrosine kinase	0.0364	0.0127	0.0127
Echinococcus granulosus	epidermal growth factor receptor	0.1025	0.7576	0.7545

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

ChEMBL: CHEMBL2229384

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 1810896