TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 304.732 | Formula: C14H13ClN4O2
H donors: 0 H acceptors: 3 LogP: 1.86 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: Clc1cccc(c1)c1nc2c(n1C)c(=O)n(c(=O)n2C)C
InChi: 1S/C14H13ClN4O2/c1-17-10-12(18(2)14(21)19(3)13(10)20)16-11(17)8-5-4-6-9(15)7-8/h4-7H,1-3H3
InChiKey: APTGRJSLXXQGSM-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
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0309	0.0098
Onchocerca volvulus	Protein ultraspiracle homolog	0.0011	0.1105	0.2229
Brugia malayi	Nuclear hormone receptor-like 1	0.0006	0.0309	0.0098
Schistosoma mansoni	retinoic acid receptor RXR	0.0011	0.1105	0.1011
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.1105	0.0911
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.1105	0.0911
Brugia malayi	photoreceptor-specific nuclear receptor	0.0011	0.1105	0.0911
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.1105	0.0911
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Brugia malayi	hypothetical protein	0.0006	0.0309	0.0098
Brugia malayi	nuclear receptor NHR-88	0.0011	0.1105	0.0911
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.1105	0.0911
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0008	0.0609	0.0509
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0011	0.1105	0.1011
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0008	0.0609	0.0404
Loa Loa (eye worm)	steroid hormone receptor	0.0011	0.1105	0.0911
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0011	0.1105	0.0911
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Schistosoma mansoni	nuclear hormone receptor	0.0005	0.0213	0.011
Toxoplasma gondii	histone lysine methyltransferase SET1	0.006	0.8507	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0011	0.1105	0.0911
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0011	0.1105	0.0911
Loa Loa (eye worm)	RNA binding protein	0.0069	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0069	1	1
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0011	0.1105	0.1011
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0011	0.1105	0.1011
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0006	0.0309	0.0098
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0011	0.1105	0.0911
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0011	0.1105	0.0911
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.1105	0.0911
Echinococcus multilocularis	tar DNA binding protein	0.0069	1	1
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0011	0.1105	0.0911
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0309	0.0098
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0008	0.0609	0.0404
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.1105	0.0911
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0011	0.1105	0.0911
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.1105	0.0911
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0011	0.1105	0.0911
Brugia malayi	ecdysteroid receptor	0.0011	0.1105	0.0911
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0008	0.0609	0.0404
Schistosoma mansoni	cpg binding protein	0.0031	0.4215	0.4154
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0011	0.1105	0.1011
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0011	0.1105	0.0911
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.1105	0.0911
Schistosoma mansoni	nuclear receptor nhr-48	0.0005	0.0213	0.011
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0011	0.1105	0.0911
Echinococcus granulosus	cpg binding protein	0.0033	0.4488	0.4368
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0011	0.1105	0.0911
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0006	0.0309	0.0098
Brugia malayi	Nuclear hormone receptor-like 1	0.0011	0.1105	0.0911
Loa Loa (eye worm)	hypothetical protein	0.0011	0.1105	0.0911
Schistosoma mansoni	coup transcription factor	0.0011	0.1105	0.1011
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0069	1	1
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0006	0.0309	0.0098
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0011	0.1105	0.0911
Loa Loa (eye worm)	hypothetical protein	0.0011	0.1105	0.0911
Loa Loa (eye worm)	hypothetical protein	0.0011	0.1105	0.0911
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0011	0.1105	0.0911
Brugia malayi	TAR-binding protein	0.0069	1	1
Schistosoma mansoni	nuclear receptor	0.0005	0.0213	0.011
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.1105	0.1011
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0011	0.1105	0.0911
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0011	0.1105	0.1011
Schistosoma mansoni	nuclear hormone receptor	0.0005	0.0213	0.011
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0504	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0006	0.0309	0.0098
Echinococcus multilocularis	FTZ F1 alpha	0.0011	0.1105	0.0911
Brugia malayi	hypothetical protein	0.0006	0.0309	0.0098
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.1105	0.0911
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.1105	0.1011
Schistosoma mansoni	tar DNA-binding protein	0.0069	1	1
Trichomonas vaginalis	helicase, putative	0.0007	0.0504	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.1105	0.0911
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.1105	0.0911
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0067	0.9594	0.959
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0.0504	1
Onchocerca volvulus		0.0011	0.1105	0.2229
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Brugia malayi	Steroid receptor seven-up type 2	0.0011	0.1105	0.0911
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0005	0.0213	0.011
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0011	0.1105	0.0911
Echinococcus granulosus	ecdysone induced protein 78C	0.0011	0.1105	0.0911
Echinococcus multilocularis	ecdysone induced protein 78C	0.0011	0.1105	0.0911
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.001	0.0901	0.0703
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0309	0.0098
Schistosoma mansoni	cpg binding protein	0.0033	0.4488	0.443
Schistosoma mansoni	RAR-like nuclear receptor	0.0011	0.1105	0.1011
Loa Loa (eye worm)	hypothetical protein	0.0011	0.1105	0.0911
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0504	1
Schistosoma mansoni	nuclear hormone receptor	0.0011	0.1105	0.1011
Brugia malayi	nuclear hormone receptor	0.0011	0.1105	0.0911
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0011	0.1105	0.0911
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0504	1
Brugia malayi	F/Y-rich N-terminus family protein	0.001	0.0882	0.0684
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0011	0.1105	0.0911
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0309	0.0098
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0011	0.1105	0.2229
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0011	0.1105	0.0911
Loa Loa (eye worm)	TAR-binding protein	0.0069	1	1
Schistosoma mansoni	cpg binding protein	0.0033	0.4488	0.443
Brugia malayi	steroid hormone receptor	0.0011	0.1105	0.0911
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0011	0.1105	0.0911
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0011	0.1105	0.0911
Echinococcus granulosus	tar DNA binding protein	0.0069	1	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0504	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0011	0.1105	0.0911
Echinococcus granulosus	FTZ F1 alpha	0.0011	0.1105	0.0911
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0011	0.1105	0.0911
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0504	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.1105	0.0911
Brugia malayi	RNA recognition motif domain containing protein	0.0069	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0011	0.1105	0.0911
Onchocerca volvulus		0.0031	0.4215	1
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0031	0.4215	0.4089
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0309	0.0098
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Schistosoma mansoni	nuclear receptor	0.0005	0.0213	0.011
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0008	0.0609	0.0404
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.001	0.0901	0.0703
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0.0504	1
Schistosoma mansoni	tar DNA-binding protein	0.0069	1	1
Brugia malayi	nuclear receptor RXR	0.0006	0.0309	0.0098
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0005	0.0213	0.011
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0011	0.1105	0.0911
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0504	1
Schistosoma mansoni	tar DNA-binding protein	0.0069	1	1
Loa Loa (eye worm)	histone methyltransferase	0.001	0.0901	0.0703
Loa Loa (eye worm)	hypothetical protein	0.0011	0.1105	0.0911
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0011	0.1105	0.1011
Schistosoma mansoni	tar DNA-binding protein	0.0069	1	1
Echinococcus multilocularis	cpg binding protein	0.0033	0.4488	0.4368
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0006	0.0309	0.0206
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0011	0.1105	0.1011
Onchocerca volvulus	Bile acid receptor homolog	0.0011	0.1105	0.2229
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0006	0.0309	0.0206
Schistosoma mansoni	zinc finger protein	0.0005	0.0213	0.011
Loa Loa (eye worm)	hypothetical protein	0.0011	0.1105	0.0911
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0504	1
Brugia malayi	CXXC zinc finger family protein	0.0031	0.4215	0.4089

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: CHEMBL484470

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 984544