TDR Targets

Basic information

Technical information

TDR Targets ID: 783219
Name: N-[4-[[6-chloro-3-(3,5-dimethylpyrazol-1-yl)q uinoxalin-2-yl]amino]phenyl]propanamide
MW: 420.895 | Formula: C22H21ClN6O
H donors: 2 H acceptors: 4 LogP: 4.46 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCC(=O)Nc1ccc(cc1)Nc1nc2ccc(cc2nc1n1nc(cc1C)C)Cl
InChi: 1S/C22H21ClN6O/c1-4-20(30)24-16-6-8-17(9-7-16)25-21-22(29-14(3)11-13(2)28-29)27-19-12-15(23)5-10-18(19)26-21/h5-12H,4H2,1-3H3,(H,24,30)(H,25,26)
InChiKey: BIEDUNPXNWANIP-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-[4-[[6-chloro-3-(3,5-dimethyl-1-pyrazolyl)-2-quinoxalinyl]amino]phenyl]propanamide
N-[4-[[6-chloro-3-(3,5-dimethylpyrazol-1-yl)quinoxalin-2-yl]amino]phenyl]propionamide

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)	acetylcholine receptor alpha subunit	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1024	0.1024
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0074	0.3617	0.3958
Toxoplasma gondii	peptidylprolyl isomerase	0.0129	0.849	1
Echinococcus granulosus	expressed protein	0.0132	0.8765	1
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Leishmania major	pantothenate kinase subunit, putative	0.0077	0.385	0.4372
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0129	0.849	1
Schistosoma mansoni	nAChR subunit	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0074	0.3617	0.3958
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0074	0.3617	0.3958
Wolbachia endosymbiont of Brugia malayi	parvulin-like peptidyl-prolyl isomerase, PPID	0.004	0.0638	1
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0146	1	1
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0074	0.3617	0.3617
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0074	0.3617	0.3617
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0146	1	1
Loa Loa (eye worm)	pantothenate kinase	0.0077	0.385	0.385
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0074	0.3617	0.3958
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0074	0.3617	0.3617
Schistosoma mansoni	tar DNA-binding protein	0.0123	0.794	0.794
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.004	0.0638	0.0477
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0048	0.1348	0.1348
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0146	1	1
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0045	0.1024	0.1024
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0244	0.0244
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0074	0.3617	0.3617
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0074	0.3617	0.3958
Leishmania major	peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative	0.0129	0.849	1
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0074	0.3617	0.3958
Plasmodium falciparum	pantothenate kinase 1, putative	0.0077	0.385	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0044	0.0993	0.0879
Brugia malayi	Cytochrome P450 family protein	0.0047	0.1257	0.1257
Loa Loa (eye worm)	RNA binding protein	0.0123	0.794	0.794
Schistosoma mansoni	tar DNA-binding protein	0.0123	0.794	0.794
Echinococcus multilocularis	expressed protein	0.0132	0.8765	1
Schistosoma mansoni	nAChR subunit	0.0074	0.3617	0.3617
Trypanosoma cruzi	pantothenate kinase subunit, putative	0.0077	0.385	0.4372
Entamoeba histolytica	hypothetical protein	0.0045	0.1024	0.0945
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Toxoplasma gondii	fumble protein	0.0077	0.385	0.4372
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0074	0.3617	0.3958
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1024	0.1024
Brugia malayi	RNA binding protein	0.0123	0.794	0.794
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0074	0.3617	0.3617
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0074	0.3617	0.3958
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0074	0.3617	0.3958
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0129	0.849	1
Schistosoma mansoni	rotamase	0.0132	0.8765	0.8765
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0074	0.3617	0.3617
Echinococcus multilocularis	glycine receptor subunit beta	0.0074	0.3617	0.3958
Loa Loa (eye worm)	GABA receptor subunit	0.0045	0.1024	0.1024
Brugia malayi	Inositol-1	0.0036	0.0244	0.0244
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, putative	0.0129	0.849	1
Echinococcus granulosus	nAChR subunit	0.0045	0.1024	0.0915
Echinococcus granulosus	nAChR subunit	0.0074	0.3617	0.3958
Onchocerca volvulus		0.0074	0.3617	0.2889
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0074	0.3617	0.3617
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0074	0.3617	0.3958
Schistosoma mansoni	nAChR subunit	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0117	0.7407	0.7407
Loa Loa (eye worm)	LGC-31 protein	0.0074	0.3617	0.3617
Echinococcus granulosus	glycine receptor subunit beta	0.0074	0.3617	0.3958
Onchocerca volvulus		0.0074	0.3617	0.2889
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1024	0.1024
Echinococcus multilocularis	nAChR subunit	0.0045	0.1024	0.0915
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Schistosoma mansoni	tar DNA-binding protein	0.0123	0.794	0.794
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0045	0.1024	0.1024
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0036	0.0244	0.5
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0074	0.3617	0.3617
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.004	0.0638	0.0477
Onchocerca volvulus		0.0146	1	1
Toxoplasma gondii	PPIC-type PPIASE domain-containing protein	0.004	0.0638	0.0477
Brugia malayi	Cation transporter family protein	0.0074	0.3617	0.3617
Trichomonas vaginalis	pantothenate kinase, putative	0.0077	0.385	0.4231
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0074	0.3617	0.3617
Loa Loa (eye worm)	Pin1-type peptidyl-prolyl cis-trans isomerase	0.0132	0.8765	0.8765
Plasmodium vivax	pantothenate kinase, putative	0.0077	0.385	0.5
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0074	0.3617	0.3958
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0074	0.3617	0.3958
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0074	0.3617	0.3617
Schistosoma mansoni	nAChR subunit	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0074	0.3617	0.3617
Trypanosoma cruzi	pantothenate kinase subunit, putative	0.0077	0.385	0.4372
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Trichomonas vaginalis	pantothenate kinase, putative	0.0077	0.385	0.4231
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1024	0.1024
Schistosoma mansoni	pantothenate kinase	0.0077	0.385	0.385
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0074	0.3617	0.3958
Onchocerca volvulus		0.0146	1	1
Schistosoma mansoni	neurotransmitter gated ion channel	0.0045	0.1024	0.1024
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Trichomonas vaginalis	pantothenate kinase, putative	0.0077	0.385	0.4231
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Onchocerca volvulus		0.0146	1	1
Giardia lamblia	Pantothenate kinase 4	0.0077	0.385	0.5
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0074	0.3617	0.3958
Schistosoma mansoni	tar DNA-binding protein	0.0123	0.794	0.794
Brugia malayi	Cation transporter family protein	0.0074	0.3617	0.3617
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0074	0.3617	0.3958
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1024	0.1024
Brugia malayi	TAR-binding protein	0.0123	0.794	0.794
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Schistosoma mansoni	nAChR subunit	0.0074	0.3617	0.3617
Schistosoma mansoni	tar DNA-binding protein	0.0123	0.794	0.794
Schistosoma mansoni	nAChR subunit	0.0074	0.3617	0.3617
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0074	0.3617	0.3958
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.004	0.0638	0.0477
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0244	0.0244
Echinococcus multilocularis	pantothenate kinase 4	0.0077	0.385	0.4231
Onchocerca volvulus	Putative nachr subunit	0.0074	0.3617	0.2889
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase/rotamase, putative	0.0129	0.849	1
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0074	0.3617	0.3617
Trichomonas vaginalis	rotamase, putative	0.0129	0.849	0.9677
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0074	0.3617	0.3617
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0045	0.1024	0.1024
Echinococcus multilocularis	tar DNA binding protein	0.0123	0.794	0.9031
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.1348	0.1348
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.1348	0.1348
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0074	0.3617	0.3617
Echinococcus granulosus	glycine receptor subunit beta	0.0074	0.3617	0.3958
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0074	0.3617	0.3617
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1024	0.1024
Trichomonas vaginalis	pantothenate kinase, putative	0.0077	0.385	0.4231
Loa Loa (eye worm)	cytochrome P450 family protein	0.0047	0.1257	0.1257
Brugia malayi	Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1	0.0132	0.8765	0.8765
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1024	0.1024
Loa Loa (eye worm)	ACC-1 protein	0.0074	0.3617	0.3617
Onchocerca volvulus	Fumble homolog	0.0077	0.385	0.3148
Echinococcus granulosus	pantothenate kinase 4	0.0077	0.385	0.4231
Trichomonas vaginalis	conserved hypothetical protein	0.0132	0.8765	1
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0045	0.1024	0.1024
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.0045	0.1024	0.1024
Loa Loa (eye worm)	hypothetical protein	0.0146	1	1
Echinococcus multilocularis	nAChR subunit	0.0074	0.3617	0.3958
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0074	0.3617	0.3958
Loa Loa (eye worm)	hypothetical protein	0.0045	0.1024	0.1024
Echinococcus multilocularis	glycine receptor subunit beta	0.0074	0.3617	0.3958
Leishmania major	peptidyl-prolyl cis-trans isomerase, putative	0.004	0.0638	0.0477
Loa Loa (eye worm)	TAR-binding protein	0.0123	0.794	0.794
Echinococcus granulosus	tar DNA binding protein	0.0123	0.794	0.9031
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0074	0.3617	0.3617
Trichomonas vaginalis	pantothenate kinase, putative	0.0077	0.385	0.4231
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0074	0.3617	0.3958
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0074	0.3617	0.3958
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0074	0.3617	0.3617
Trypanosoma brucei	pantothenate kinase subunit, putative	0.0077	0.385	0.4372
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.1348	0.1348
Trichomonas vaginalis	rotamase, putative	0.0132	0.8765	1
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0074	0.3617	0.3617
Schistosoma mansoni	nAChR subunit	0.0074	0.3617	0.3617
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0123	0.794	0.794
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0074	0.3617	0.3617
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0045	0.1024	0.1024
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0074	0.3617	0.3617
Onchocerca volvulus		0.0074	0.3617	0.2889
Brugia malayi	pantothenate kinase family protein	0.0077	0.385	0.385
Entamoeba histolytica	pantothenate kinase 1, putative	0.0077	0.385	0.4372
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0074	0.3617	0.3958
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0074	0.3617	0.3617
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0074	0.3617	0.3958
Loa Loa (eye worm)	inositol-1	0.0036	0.0244	0.0244
Schistosoma mansoni	pantothenate kinase	0.0077	0.385	0.385
Brugia malayi	excitatory GABA receptor EXP-1A	0.0074	0.3617	0.3617
Loa Loa (eye worm)	ACC-1 protein	0.0074	0.3617	0.3617
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0074	0.3617	0.3617
Brugia malayi	RNA recognition motif domain containing protein	0.0123	0.794	0.794

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 783219