TDR Targets

Basic information

Technical information

TDR Targets ID: 877962
Name: ethyl 4-[(4-methyl-2-oxo-1H-quinolin-6-yl)sul fonylamino]benzoate
MW: 386.422 | Formula: C19H18N2O5S
H donors: 2 H acceptors: 5 LogP: 3.28 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)c1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)c(C)cc(n2)O
InChi: 1S/C19H18N2O5S/c1-3-26-19(23)13-4-6-14(7-5-13)21-27(24,25)15-8-9-17-16(11-15)12(2)10-18(22)20-17/h4-11,21H,3H2,1-2H3,(H,20,22)
InChiKey: NYCPPKMMIQLQFB-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

4-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonylamino]benzoic acid ethyl ester
4-[(2-keto-4-methyl-1H-quinolin-6-yl)sulfonylamino]benzoic acid ethyl ester

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
Brugia malayi	FAD binding domain containing protein	0.0756	1	1
Loa Loa (eye worm)	flavodoxin family protein	0.0289	0.3673	0.3673
Schistosoma mansoni	NADH-cytochrome B5 reductase	0.0086	0.0919	0.0611
Onchocerca volvulus		0.0086	0.0919	0.5
Trypanosoma brucei	oxidoreductase-protein, putative	0.0086	0.0919	0.0735
Trypanosoma cruzi	Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative	0.0289	0.3673	0.3545
Trichomonas vaginalis	NADPH fad oxidoreductase, putative	0.067	0.8835	0.8806
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Mycobacterium ulcerans	flavodoxin oxidoreductase	0.0086	0.0919	0.0735
Leishmania major	nitrate reductase, putative	0.0086	0.0919	0.0735
Brugia malayi	Cytochrome P450 family protein	0.0054	0.0488	0.0296
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Schistosoma mansoni	5-methyl tetrahydrofolate-homocysteine methyltransferase reductase	0.0467	0.6081	0.5948
Mycobacterium tuberculosis	Hypothetical oxidoreductase	0.0086	0.0919	0.5
Entamoeba histolytica	type A flavoprotein, putative	0.0289	0.3673	0.5
Entamoeba histolytica	type A flavoprotein, putative	0.0289	0.3673	0.5
Loa Loa (eye worm)	cytochrome P450 family protein	0.0054	0.0488	0.0488
Leishmania major	oxidoreductase-like protein	0.0086	0.0919	0.0735
Trypanosoma brucei	S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative	0.0289	0.3673	0.3545
Mycobacterium ulcerans	electron transfer protein FdxB	0.0086	0.0919	0.0735
Entamoeba histolytica	type A flavoprotein, putative	0.0289	0.3673	0.5
Trypanosoma cruzi	NADPH--cytochrome P450 reductase, putative	0.0289	0.3673	0.3545
Mycobacterium tuberculosis	Possible electron transfer protein FdxB	0.0086	0.0919	0.5
Loa Loa (eye worm)	FAD binding domain-containing protein	0.0756	1	1
Toxoplasma gondii	flavodoxin domain-containing protein	0.0375	0.4838	1
Leishmania major	cytochrome-b5 reductase, putative	0.0086	0.0919	0.0735
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0039	0.0279	0.0279
Leishmania major	cytochrome P450 reductase, putative	0.067	0.8835	0.8812
Echinococcus multilocularis	methionine synthase reductase	0.0467	0.6081	0.5968
Echinococcus multilocularis	NADH cytochrome b5 reductase 3	0.0086	0.0919	0.0658
Echinococcus granulosus	cytochrome b5 reductase 4	0.0086	0.0919	0.0658
Toxoplasma gondii	flavodoxin domain-containing protein	0.0375	0.4838	1
Trichomonas vaginalis	sulfite reductase, putative	0.0756	1	1
Echinococcus granulosus	cytochrome b5 reductase 4	0.0086	0.0919	0.0658
Mycobacterium ulcerans	flavodoxin reductase Hmp	0.0086	0.0919	0.0735
Trypanosoma cruzi	NADPH-dependent FMN/FAD containing oxidoreductase, putative	0.0756	1	1
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Mycobacterium ulcerans	oxidoreductase	0.0086	0.0919	0.0735
Giardia lamblia	Nitric oxide synthase, inducible	0.067	0.8835	1
Mycobacterium ulcerans	formate dehydrogenase H FdhF	0.0756	1	1
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Loa Loa (eye worm)	CYP4Cod1	0.0033	0.0199	0.0199
Treponema pallidum	flavodoxin	0.0289	0.3673	1
Trichomonas vaginalis	NADPH cytochrome P450, putative	0.0289	0.3673	0.3514
Giardia lamblia	Hypothetical protein	0.067	0.8835	1
Trypanosoma cruzi	oxidoreductase-like protein, putative	0.0086	0.0919	0.0735
Echinococcus granulosus	NADH cytochrome b5 reductase 3	0.0086	0.0919	0.0658
Echinococcus granulosus	methionine synthase reductase	0.0467	0.6081	0.5968
Schistosoma mansoni	NADPH flavin oxidoreductase	0.0381	0.4916	0.4744
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Plasmodium falciparum	nitric oxide synthase, putative	0.0756	1	1
Leishmania major	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Trichomonas vaginalis	NADPH cytochrome P450, putative	0.0289	0.3673	0.3514
Leishmania major	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Echinococcus multilocularis	NADPH cytochrome P450 reductase	0.0756	1	1
Trypanosoma cruzi	cytochrome-b5 reductase, putative	0.0086	0.0919	0.0735
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Plasmodium falciparum	NADPH--cytochrome P450 reductase, putative	0.0289	0.3673	0.3033
Entamoeba histolytica	type A flavoprotein, putative	0.0289	0.3673	0.5
Trypanosoma cruzi	oxidoreductase-protein, putative	0.0086	0.0919	0.0735
Brugia malayi	Cytochrome b5-like Heme/Steroid binding domain containing protein	0.0086	0.0919	0.0735
Trypanosoma cruzi	Flavodoxin/Radical SAM superfamily/Wyosine base formation, putative	0.0289	0.3673	0.3545
Brugia malayi	diaphorase	0.0086	0.0919	0.0735
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Leishmania major	NADH-dependent fumarate reductase-like protein	0.0086	0.0919	0.0735
Trypanosoma cruzi	cytochrome P450 reductase, putative	0.0756	1	1
Trypanosoma brucei	nitrate reductase, putative	0.0086	0.0919	0.0735
Brugia malayi	FAD binding domain containing protein	0.0467	0.6081	0.6001
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Mycobacterium tuberculosis	Probable oxidoreductase	0.0086	0.0919	0.5
Schistosoma mansoni	diflavin oxidoreductase	0.0375	0.4838	0.4663
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Plasmodium falciparum	S-adenosyl-L-methionine-dependent tRNA 4-demethylwyosine synthase, putative	0.0289	0.3673	0.3033
Trypanosoma cruzi	cytochrome-b5 reductase, putative	0.0086	0.0919	0.0735
Leishmania major	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Trichomonas vaginalis	NADPH cytochrome P450, putative	0.0289	0.3673	0.3514
Trypanosoma cruzi	p450 reductase, putative	0.0756	1	1
Trypanosoma cruzi	reductase, putative	0.0086	0.0919	0.0735
Trypanosoma brucei	NADPH-cytochrome p450 reductase, putative	0.0756	1	1
Plasmodium vivax	NADPH-cytochrome p450 reductase, putative	0.0756	1	1
Echinococcus multilocularis	cytochrome b5 reductase 4	0.0086	0.0919	0.0658
Loa Loa (eye worm)	hypothetical protein	0.0756	1	1
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0039	0.0279	0.0082
Plasmodium vivax	hypothetical protein, conserved	0.0289	0.3673	0.3033
Mycobacterium ulcerans	oxygenase	0.0086	0.0919	0.0735
Trypanosoma cruzi	nitrate reductase, putative	0.0086	0.0919	0.0735
Mycobacterium ulcerans	monooxygenase	0.0086	0.0919	0.0735
Trypanosoma brucei	NADH-dependent fumarate reductase	0.0086	0.0919	0.0735
Loa Loa (eye worm)	FAD binding domain-containing protein	0.0467	0.6081	0.6081
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Leishmania major	cytochrome-b5 reductase, putative	0.0086	0.0919	0.0735
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Mycobacterium tuberculosis	Possible oxygenase	0.0086	0.0919	0.5
Trypanosoma brucei	NADPH-dependent diflavin oxidoreductase 1	0.0756	1	1
Schistosoma mansoni	cytochrome B5	0.0086	0.0919	0.0611
Mycobacterium tuberculosis	Probable monooxygenase	0.0086	0.0919	0.5
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Echinococcus multilocularis	NADPH dependent diflavin oxidoreductase 1	0.0756	1	1
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Leishmania major	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Schistosoma mansoni	cytochrome P450 reductase	0.0756	1	1
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Trypanosoma brucei	NADH-dependent fumarate reductase	0.0086	0.0919	0.0735
Loa Loa (eye worm)	cytochrome b5 reductase 4	0.0086	0.0919	0.0919
Trypanosoma brucei	NADPH--cytochrome P450 reductase, putative	0.0756	1	1
Chlamydia trachomatis	sulfite reductase	0.0467	0.6081	1
Plasmodium vivax	flavodoxin domain containing protein	0.067	0.8835	0.8717
Brugia malayi	flavodoxin family protein	0.0289	0.3673	0.3545
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Echinococcus granulosus	NADPH dependent diflavin oxidoreductase 1	0.0756	1	1
Trichomonas vaginalis	NADPH cytochrome P450, putative	0.0289	0.3673	0.3514
Trypanosoma cruzi	p450 reductase, putative	0.0086	0.0919	0.0735
Trypanosoma cruzi	cytochrome P450 reductase, putative	0.0756	1	1
Loa Loa (eye worm)	cytochrome P450 family protein	0.0033	0.0199	0.0199
Trypanosoma brucei	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Loa Loa (eye worm)	cytochrome P450 family protein	0.0033	0.0199	0.0199
Leishmania major	reductase, putative	0.0086	0.0919	0.0735
Loa Loa (eye worm)	diaphorase	0.0086	0.0919	0.0919
Trypanosoma brucei	NADH-cytochrome b5 reductase-like protein	0.0086	0.0919	0.0735
Entamoeba histolytica	type A flavoprotein, putative	0.0289	0.3673	0.5
Leishmania major	p450 reductase, putative	0.0756	1	1
Echinococcus granulosus	NADPH cytochrome P450 reductase	0.0756	1	1
Leishmania major	hypothetical protein, conserved	0.0289	0.3673	0.3545
Trypanosoma cruzi	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Trypanosoma brucei	NADPH--cytochrome P450 reductase, putative	0.0756	1	1
Trypanosoma brucei	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735
Loa Loa (eye worm)	hypothetical protein	0.0034	0.021	0.021
Leishmania major	NADPH-cytochrome p450 reductase-like protein	0.0756	1	1
Trypanosoma brucei	NADH-dependent fumarate reductase, putative	0.0086	0.0919	0.0735
Trypanosoma cruzi	NADH-cytochrome b5 reductase, putative	0.0086	0.0919	0.0735

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 877962