TDR Targets

Basic information

Technical information

TDR Targets ID: 869677
Name: N-(3-chloro-2-methylphenyl)-2,6-dimethyl-2,3- dihydro-1,4-benzoxazine-4-carboxamide
MW: 330.809 | Formula: C18H19ClN2O2
H donors: 1 H acceptors: 1 LogP: 4.2 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: CC1Oc2ccc(cc2N(C1)C(=O)Nc1cccc(c1C)Cl)C
InChi: 1S/C18H19ClN2O2/c1-11-7-8-17-16(9-11)21(10-12(2)23-17)18(22)20-15-6-4-5-14(19)13(15)3/h4-9,12H,10H2,1-3H3,(H,20,22)
InChiKey: VNZATUQUBBHAKK-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

N-(3-chloro-2-methyl-phenyl)-2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carboxamide

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
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Echinococcus multilocularis	cathepsin L cysteine protease	0.0757	0.1914	0.1914
Brugia malayi	Cathepsin L-like precursor	0.0757	0.1914	0.1914
Brugia malayi	Cathepsin L-like precursor	0.0757	0.1914	0.1914
Brugia malayi	Cathepsin L-like precursor	0.0527	0.0609	0.0609
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0757	0.1914	0.1914
Onchocerca volvulus	Cathepsin L homolog	0.0757	0.1914	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Onchocerca volvulus		0.0757	0.1914	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Entamoeba histolytica	cysteine protease, putative	0.0757	0.1914	1
Echinococcus multilocularis	cathepsin b	0.2182	1	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0757	0.1914	0.1914
Loa Loa (eye worm)	cathepsin B	0.0806	0.2191	0.1685
Loa Loa (eye worm)	fibroinase	0.0757	0.1914	0.139
Giardia lamblia	Cathepsin B precursor	0.0806	0.2191	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Brugia malayi	Cathepsin L-like precursor	0.0757	0.1914	0.1914
Trypanosoma cruzi	cruzipain precursor, putative	0.1378	0.5436	0.5436
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0806	0.2191	0.2191
Toxoplasma gondii	cathepsin B	0.0806	0.2191	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0757	0.1914	0.1914
Leishmania major	cathepsin L-like protease	0.1378	0.5436	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Onchocerca volvulus	Cathepsin L homolog	0.0757	0.1914	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0757	0.1914	0.8735
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Leishmania major	cathepsin L-like protease	0.1378	0.5436	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0527	0.0609	0.0609
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Brugia malayi	Cathepsin L-like precursor	0.0757	0.1914	0.1914
Brugia malayi	cathepsin L-like precursor	0.0527	0.0609	0.0609
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0527	0.0609	0.2779
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0757	0.1914	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0757	0.1914	0.1914
Echinococcus multilocularis	cysteine protease	0.0757	0.1914	0.1914
Entamoeba histolytica	cysteine proteinase, putative	0.0757	0.1914	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0806	0.2191	0.2191
Trypanosoma cruzi	cysteine peptidase, putative	0.1378	0.5436	0.5436
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0806	0.2191	0.0787
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Echinococcus multilocularis	cathepsin L cysteine protease	0.0757	0.1914	0.1914
Loa Loa (eye worm)	hypothetical protein	0.0757	0.1914	0.139
Onchocerca volvulus	Cathepsin F homolog	0.0757	0.1914	1
Echinococcus multilocularis	cysteine protease	0.0757	0.1914	0.1914
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0527	0.0609	0.2779
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Plasmodium vivax	vivapain-2	0.0757	0.1914	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Giardia lamblia	Cathepsin B precursor	0.0806	0.2191	0.5
Trypanosoma cruzi	cysteine peptidase, putative	0.0757	0.1914	0.1914
Trypanosoma cruzi	cysteine peptidase, putative	0.1378	0.5436	0.5436
Echinococcus granulosus	cathepsin l1	0.0757	0.1914	0.1914
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0757	0.1914	0.139
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Trypanosoma cruzi	major cysteine proteinase, putative	0.081	0.2217	0.2217
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2182	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0806	0.2191	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0757	0.1914	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0757	0.1914	0.139
Brugia malayi	Cathepsin L-like precursor	0.0757	0.1914	0.1914
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Plasmodium vivax	vivapain-2	0.0757	0.1914	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.1148	0.4131	0.4131
Echinococcus granulosus	cathepsin l1	0.0527	0.0609	0.0609
Loa Loa (eye worm)	cysteine protease	0.0757	0.1914	0.139
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0757	0.1914	0.8735
Schistosoma mansoni	cathepsin F (C01 family)	0.0757	0.1914	0.1914
Brugia malayi	Cathepsin L-like precursor	0.0757	0.1914	0.1914
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0757	0.1914	0.1914
Leishmania major	cathepsin L-like protease	0.1378	0.5436	1
Onchocerca volvulus		0.0757	0.1914	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0757	0.1914	1
Loa Loa (eye worm)	ctsf protein	0.0757	0.1914	0.139
Entamoeba histolytica	cysteine proteinase, putative	0.0527	0.0609	0.3182
Onchocerca volvulus		0.0757	0.1914	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Echinococcus granulosus	cathepsin b	0.2182	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0757	0.1914	0.8735
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0806	0.2191	0.4031
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Entamoeba histolytica	cysteine proteinase, putative	0.0757	0.1914	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Onchocerca volvulus		0.0757	0.1914	1
Brugia malayi	Cathepsin L-like precursor	0.0527	0.0609	0.0609
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2182	1	1
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.2182	1	1
Loa Loa (eye worm)	hypothetical protein	0.2182	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0757	0.1914	0.8735
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.2182	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Echinococcus multilocularis	cathepsin b	0.2182	1	1
Echinococcus granulosus	cathepsin b	0.2182	1	1
Onchocerca volvulus		0.0757	0.1914	1
Brugia malayi	Papain family cysteine protease containing protein	0.0757	0.1914	0.1914
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.2182	1	1
Onchocerca volvulus		0.0757	0.1914	1
Onchocerca volvulus		0.0757	0.1914	1
Giardia lamblia	Cathepsin B precursor	0.0806	0.2191	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.1378	0.5436	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0527	0.0609	0.0609
Trypanosoma cruzi	cysteine peptidase, putative	0.1378	0.5436	0.5436

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 869677