TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 269.27 | Formula: C16H12FNO2
H donors: 1 H acceptors: 1 LogP: 3.26 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: CNc1ccc(cc1)c1cc(=O)c2c(o1)ccc(c2)F
InChi: 1S/C16H12FNO2/c1-18-12-5-2-10(3-6-12)16-9-14(19)13-8-11(17)4-7-15(13)20-16/h2-9,18H,1H3
InChiKey: WTLZONGTQDIGMQ-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

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
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.2424	1
Schistosoma mansoni	tar DNA-binding protein	0.0063	1	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0191	0.0191
Toxoplasma gondii	ImpB/MucB/SamB family protein	0.0031	0.4465	1
Brugia malayi	Intermediate filament tail domain containing protein	0.0031	0.4494	0.4494
Loa Loa (eye worm)	intermediate filament protein	0.0031	0.4494	0.4494
Loa Loa (eye worm)	hypothetical protein	0.0044	0.6699	0.6699
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.1419	0.1887
Leishmania major	DNA polymerase eta, putative	0.0044	0.6699	1
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.2413	0.9948
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Trichomonas vaginalis	DNA polymerase eta, putative	0.0019	0.2424	1
Echinococcus granulosus	dna polymerase kappa	0.0019	0.2424	0.2424
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0031	0.4494	0.4494
Echinococcus granulosus	intermediate filament protein	0.0031	0.4494	0.4494
Trypanosoma brucei	unspecified product	0.0013	0.1419	0.1887
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.1419	0.1887
Loa Loa (eye worm)	hypothetical protein	0.0015	0.1748	0.1748
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.2424	0.2424
Schistosoma mansoni	lamin	0.0031	0.4494	0.4494
Schistosoma mansoni	DNA polymerase IV / kappa	0.0006	0.0191	0.0191
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0063	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.2413	1
Leishmania major	DNA polymerase eta, putative	0.0031	0.4465	0.6568
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0019	0.2424	0.2424
Schistosoma mansoni	tar DNA-binding protein	0.0063	1	1
Toxoplasma gondii	exonuclease III APE	0.0019	0.2413	0.5197
Loa Loa (eye worm)	hypothetical protein	0.003	0.4397	0.4397
Trypanosoma brucei	unspecified product	0.0019	0.2424	0.3432
Schistosoma mansoni	lamin	0.0031	0.4494	0.4494
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0019	0.2424	1
Brugia malayi	RNA recognition motif domain containing protein	0.0063	1	1
Schistosoma mansoni	ap endonuclease	0.0019	0.2413	0.2413
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0016	0.203	0.203
Schistosoma mansoni	tar DNA-binding protein	0.0063	1	1
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0015	0.1748	0.1748
Echinococcus granulosus	tar DNA binding protein	0.0063	1	1
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0019	0.2424	0.2424
Echinococcus multilocularis	musashi	0.0031	0.4494	0.4494
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Brugia malayi	polk-prov protein	0.0006	0.0191	0.0191
Schistosoma mansoni	DNA polymerase eta	0.0044	0.6699	0.6699
Leishmania major	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.2413	0.2413
Trypanosoma cruzi	DNA polymerase eta, putative	0.0031	0.4465	0.6568
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.2413	1
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.2413	0.5
Loa Loa (eye worm)	TAR-binding protein	0.0063	1	1
Trypanosoma cruzi	DNA polymerase eta, putative	0.0044	0.6699	1
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0019	0.2424	0.2424
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0019	0.2424	0.3432
Schistosoma mansoni	ap endonuclease	0.0019	0.2413	0.2413
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.2424	0.3432
Echinococcus granulosus	dna polymerase eta	0.0044	0.6699	0.6699
Brugia malayi	intermediate filament protein	0.0031	0.4494	0.4494
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.1419	0.1887
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.2413	0.3414
Loa Loa (eye worm)	hypothetical protein	0.0014	0.165	0.165
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0019	0.2424	0.2424
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Brugia malayi	TAR-binding protein	0.0063	1	1
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0019	0.2424	1
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.2413	0.2413
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0019	0.2424	0.2424
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.2413	0.3414
Trypanosoma brucei	unspecified product	0.0013	0.1419	0.1887
Schistosoma mansoni	intermediate filament proteins	0.0031	0.4494	0.4494
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.2413	0.2413
Brugia malayi	ImpB/MucB/SamB family protein	0.0044	0.6699	0.6699
Echinococcus multilocularis	lamin	0.0031	0.4494	0.4494
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0015	0.1748	0.1748
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.2413	0.2413
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.2413	0.5
Onchocerca volvulus		0.0031	0.4494	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Echinococcus multilocularis	lamin dm0	0.0031	0.4494	0.4494
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Echinococcus granulosus	lamin dm0	0.0031	0.4494	0.4494
Loa Loa (eye worm)	hypothetical protein	0.0031	0.4494	0.4494
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0019	0.2424	1
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.2413	0.3414
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Loa Loa (eye worm)	RNA binding protein	0.0063	1	1
Trypanosoma brucei	DNA polymerase eta, putative	0.0044	0.6699	1
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.2424	0.3432
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0.2413	0.9948
Schistosoma mansoni	tar DNA-binding protein	0.0063	1	1
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.2424	1
Echinococcus multilocularis	tar DNA binding protein	0.0063	1	1
Echinococcus multilocularis	dna polymerase eta	0.0044	0.6699	0.6699
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0019	0.2424	1
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.2413	0.3414
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Schistosoma mansoni	tar DNA-binding protein	0.0063	1	1
Onchocerca volvulus		0.0031	0.4494	1
Brugia malayi	cytoplasmic intermediate filament protein	0.0016	0.203	0.203
Echinococcus granulosus	lamin	0.0031	0.4494	0.4494
Loa Loa (eye worm)	hypothetical protein	0.0014	0.165	0.165
Giardia lamblia	DINP protein human, muc B family	0.0019	0.2424	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.2424	0.3432
Echinococcus multilocularis	dna polymerase kappa	0.0019	0.2424	0.2424
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.2424	0.3432

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: CHEMBL500721

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 1002980