TDR Targets

Basic information

Technical information

TDR Targets ID: 896697
Name: butyl 6-[(3,4-dichlorophenyl)sulfamoyl]-2-oxo -1,3-benzoxazole-3-carboxylate
MW: 459.3 | Formula: C18H16Cl2N2O6S
H donors: 1 H acceptors: 4 LogP: 4.54 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCCCOC(=O)n1c(=O)oc2c1ccc(c2)S(=O)(=O)Nc1ccc(c(c1)Cl)Cl
InChi: 1S/C18H16Cl2N2O6S/c1-2-3-8-27-17(23)22-15-7-5-12(10-16(15)28-18(22)24)29(25,26)21-11-4-6-13(19)14(20)9-11/h4-7,9-10,21H,2-3,8H2,1H3
InChiKey: XHLRSUNRVGQYSK-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

6-[(3,4-dichlorophenyl)sulfamoyl]-2-oxo-1,3-benzoxazole-3-carboxylic acid butyl ester
6-[(3,4-dichlorophenyl)sulfamoyl]-2-keto-1,3-benzoxazole-3-carboxylic acid butyl ester
ZINC03158340

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
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0019	0.7511	0.7367
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	1	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0546	0.0546
Leishmania major	DNA polymerase kappa, putative	0.0019	0.7511	0.7367
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.7233	1
Mycobacterium tuberculosis	Phenyloxazoline synthase MbtB (phenyloxazoline synthetase)	0.0007	0.0546	0.0546
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	1	1
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0019	0.7511	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.6071	0.6071
Loa Loa (eye worm)	hypothetical protein	0.0019	0.7511	0.7367
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	1	1
Schistosoma mansoni	ap endonuclease	0.0019	0.7233	0.9601
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0019	0.7511	0.7511
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.7511	1
Leishmania major	DNA polymerase eta, putative	0.0019	0.7511	0.7367
Mycobacterium ulcerans	hypothetical protein	0.0023	1	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.6071	0.6071
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.413	0.5145
Plasmodium vivax	acyl-CoA synthetase, putative	0.0018	0.6617	0.9078
Trypanosoma brucei	unspecified product	0.0019	0.7511	1
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.7233	0.7073
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	1	1
Trichomonas vaginalis	DNA polymerase eta, putative	0.0019	0.7511	1
Loa Loa (eye worm)	hypothetical protein	0.0023	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.413	0.5145
Giardia lamblia	DINP protein human, muc B family	0.0019	0.7511	1
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0019	0.7511	1
Plasmodium falciparum	acyl-CoA synthetase	0.0018	0.6617	0.9078
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.7511	1
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0.7233	0.7073
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.7511	1
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.7233	0.9601
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	1	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.6617	0.6421
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.7511	1
Echinococcus granulosus	dna polymerase eta	0.0019	0.7511	1
Mycobacterium tuberculosis	Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase)	0.0007	0.0546	0.0546
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	1	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	1	1
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.7233	0.7073
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.7511	0.7367
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0019	0.7511	0.7511
Entamoeba histolytica	acyl-coA synthetase, putative	0.0023	1	1
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.7233	0.9601
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Schistosoma mansoni	DNA polymerase eta	0.0019	0.7511	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.413	0.5145
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	1	1
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0019	0.7511	0.7367
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.7233	0.5
Echinococcus granulosus	dna polymerase kappa	0.0019	0.7511	1
Echinococcus multilocularis	dna polymerase eta	0.0019	0.7511	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.7511	1
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	1	1
Loa Loa (eye worm)	hypothetical protein	0.0023	1	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.6617	0.6421
Trypanosoma brucei	unspecified product	0.0013	0.413	0.5145
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.7233	0.9601
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.7233	0.7233
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Echinococcus multilocularis	dna polymerase kappa	0.0019	0.7511	1
Onchocerca volvulus		0.0023	1	1
Loa Loa (eye worm)	hypothetical protein	0.0023	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.7233	0.9601
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.7511	0.7367
Mycobacterium tuberculosis	Peptide synthetase MbtE (peptide synthase)	0.0007	0.0546	0.0546
Schistosoma mansoni	ap endonuclease	0.0019	0.7233	0.9601
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.7233	0.7073
Trypanosoma brucei	unspecified product	0.0013	0.413	0.5145
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.7511	0.7367
Toxoplasma gondii	exonuclease III APE	0.0019	0.7233	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.6071	0.6071
Loa Loa (eye worm)	hypothetical protein	0.0018	0.6617	0.6421
Mycobacterium tuberculosis	Probable peptide synthetase Nrp (peptide synthase)	0.0007	0.0546	0.0546
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0019	0.7511	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.6617	0.6421
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.7233	0.7073
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.7511	1
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0546	0.0546
Trypanosoma cruzi	DNA polymerase eta, putative	0.0019	0.7511	1
Brugia malayi	AMP-binding enzyme family protein	0.0023	1	1
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	1	1
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0019	0.7511	0.7367
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Mycobacterium tuberculosis	Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0546	0.0546
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0.7233	0.9601
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0019	0.7511	1
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0018	0.6617	0.5
Mycobacterium tuberculosis	Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase	0.0007	0.0546	0.0546
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0007	0.0546	0.0546
Loa Loa (eye worm)	hypothetical protein	0.0018	0.6617	0.6421
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	1	1
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.7233	0.5
Brugia malayi	AMP-binding enzyme family protein	0.0023	1	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	1	1
Mycobacterium tuberculosis	P-hydroxybenzoyl-AMP ligase FadD22	0.0007	0.0546	0.0546
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0019	0.7511	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	1	1
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.7233	0.9601
Trypanosoma brucei	DNA polymerase eta, putative	0.0019	0.7511	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.7511	1
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.7511	0.7367
Mycobacterium tuberculosis	Peptide synthetase MbtF (peptide synthase)	0.0007	0.0546	0.0546
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.6071	0.6071
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.7233	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	1	1
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.6617	0.6617
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0018	0.6617	0.6421
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0.7233	0.9601
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	1	1
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.7511	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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 896697