TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 354.787 | Formula: C19H15ClN2O3
H donors: 2 H acceptors: 1 LogP: 3.93 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(c2c1/C(=C\c1c(Cl)[nH]c3c1cccc3)/C(=O)N2)OC
InChi: 1S/C19H15ClN2O3/c1-24-14-7-8-15(25-2)17-16(14)12(19(23)22-17)9-11-10-5-3-4-6-13(10)21-18(11)20/h3-9,21H,1-2H3,(H,22,23)/b12-9+
InChiKey: RSZIXJIZNSKHFE-FMIVXFBMSA-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

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
Trypanosoma cruzi	cysteine peptidase, putative	0.017	0.8704	0.8386
Brugia malayi	Cathepsin L-like precursor	0.017	0.8704	0.8704
Loa Loa (eye worm)	fibroinase	0.017	0.8704	0.8704
Echinococcus granulosus	cysteine protease	0.009	0.256	0.256
Giardia lamblia	Cathepsin B precursor	0.0082	0.1967	0.5
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.009	0.256	0.0738
Brugia malayi	Cathepsin L-like precursor	0.0116	0.4515	0.4515
Schistosoma mansoni	cathepsin F (C01 family)	0.0116	0.4515	0.4515
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0116	0.4515	0.3781
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Entamoeba histolytica	cysteine protease, putative	0.017	0.8704	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.017	0.8704	1
Brugia malayi	Cathepsin L-like precursor	0.017	0.8704	0.8704
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Echinococcus multilocularis	cysteine protease	0.017	0.8704	0.8704
Echinococcus multilocularis	cathepsin b	0.0187	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.009	0.256	0.256
Entamoeba histolytica	cysteine proteinase, putative	0.0116	0.4515	0.3182
Loa Loa (eye worm)	cathepsin B	0.0082	0.1967	0.1967
Brugia malayi	Cathepsin L-like precursor	0.0116	0.4515	0.4515
Echinococcus multilocularis	cathepsin L cysteine protease	0.017	0.8704	0.8704
Onchocerca volvulus		0.0116	0.4515	0.5187
Trypanosoma cruzi	cysteine proteinase, putative	0.009	0.256	0.0738
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.009	0.256	0.256
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0116	0.4515	0.4515
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.009	0.256	0.0879
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.017	0.8704	0.8704
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.256	0.0879
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Brugia malayi	cathepsin L-like precursor	0.0116	0.4515	0.4515
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.017	0.8704	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Giardia lamblia	Cathepsin B precursor	0.0082	0.1967	0.5
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0187	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Loa Loa (eye worm)	hypothetical protein	0.0116	0.4515	0.4515
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Entamoeba histolytica	cysteine proteinase, putative	0.017	0.8704	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.017	0.8704	0.8704
Echinococcus granulosus	cathepsin L cysteine proteinase	0.017	0.8704	0.8704
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.009	0.256	0.0879
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0187	1	1
Brugia malayi	Cathepsin L-like precursor	0.017	0.8704	0.8704
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Loa Loa (eye worm)	hypothetical protein	0.0116	0.4515	0.4515
Leishmania major	cathepsin L-like protease	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Onchocerca volvulus		0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Trypanosoma cruzi	cysteine protease, putative	0.009	0.256	0.0738
Trypanosoma cruzi	cysteine proteinase, putative	0.009	0.256	0.0738
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.009	0.256	0.0879
Brugia malayi	Papain family cysteine protease containing protein	0.009	0.256	0.256
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.017	0.8704	0.8704
Leishmania major	cathepsin L-like protease	0.017	0.8704	1
Onchocerca volvulus	Cathepsin F homolog	0.017	0.8704	1
Leishmania major	cathepsin L-like protease	0.017	0.8704	1
Leishmania major	cathepsin L-like protease	0.017	0.8704	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.009	0.256	0.256
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Onchocerca volvulus		0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.017	0.8704	0.8704
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0187	1	1
Loa Loa (eye worm)	hypothetical protein	0.0116	0.4515	0.4515
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0187	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Echinococcus granulosus	cathepsin L cysteine protease	0.009	0.256	0.256
Echinococcus multilocularis	cathepsin b	0.0187	1	1
Onchocerca volvulus		0.017	0.8704	1
Echinococcus granulosus	cathepsin b	0.0187	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Toxoplasma gondii	cathepsin CPL	0.017	0.8704	1
Trypanosoma cruzi	cysteine peptidase, putative	0.017	0.8704	0.8386
Onchocerca volvulus		0.017	0.8704	1
Leishmania major	cathepsin L-like protease	0.017	0.8704	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Brugia malayi	Cathepsin L-like precursor	0.017	0.8704	0.8704
Onchocerca volvulus	Cathepsin L homolog	0.017	0.8704	1
Trypanosoma cruzi	cysteine peptidase, putative	0.017	0.8704	0.8386
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.017	0.8704	0.8704
Schistosoma mansoni	cathepsin F (C01 family)	0.017	0.8704	0.8704
Brugia malayi	Cathepsin L-like precursor	0.017	0.8704	0.8704
Plasmodium vivax	vivapain-2	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.017	0.8704	0.8704
Brugia malayi	Papain family cysteine protease containing protein	0.009	0.256	0.256
Leishmania major	cathepsin L-like protease	0.017	0.8704	1
Leishmania major	cysteine peptidase A (CPA)	0.017	0.8704	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0116	0.4515	0.3781
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0082	0.1967	0.1967
Brugia malayi	Papain family cysteine protease containing protein	0.017	0.8704	0.8704
Leishmania major	cathepsin L-like protease	0.017	0.8704	1
Echinococcus granulosus	cathepsin L	0.009	0.256	0.256
Schistosoma mansoni	cathepsin F (C01 family)	0.017	0.8704	0.8704
Plasmodium falciparum	cysteine proteinase falcipain 3	0.017	0.8704	1
Leishmania major	cathepsin L-like protease	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.017	0.8704	1
Trypanosoma cruzi	cruzipain precursor, putative	0.017	0.8704	0.8386
Giardia lamblia	Cathepsin B precursor	0.0082	0.1967	0.5
Trypanosoma cruzi	cysteine peptidase, putative	0.017	0.8704	0.8386
Onchocerca volvulus		0.017	0.8704	1
Loa Loa (eye worm)	ctsf protein	0.017	0.8704	0.8704
Plasmodium vivax	vivapain-2	0.017	0.8704	1
Loa Loa (eye worm)	hypothetical protein	0.0187	1	1
Loa Loa (eye worm)	cysteine protease	0.017	0.8704	0.8704
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0187	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.017	0.8704	1
Onchocerca volvulus		0.017	0.8704	1
Echinococcus granulosus	cathepsin b	0.0187	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Loa Loa (eye worm)	hypothetical protein	0.017	0.8704	0.8704
Echinococcus multilocularis	cysteine protease	0.017	0.8704	0.8704
Brugia malayi	Cathepsin L-like precursor	0.017	0.8704	0.8704
Trypanosoma cruzi	cysteine peptidase, putative	0.009	0.256	0.0738
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Echinococcus multilocularis	cathepsin L	0.009	0.256	0.256
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.017	0.8704	1
Echinococcus granulosus	cathepsin l1	0.017	0.8704	0.8704
Echinococcus granulosus	cathepsin l1	0.0116	0.4515	0.4515
Onchocerca volvulus	Cathepsin L homolog	0.017	0.8704	1
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0116	0.4515	0.3171
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.017	0.8704	1
Entamoeba histolytica	cysteine proteinase, putative	0.017	0.8704	1
Onchocerca volvulus		0.017	0.8704	1

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: CHEMBL3235815

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 1883466