TDR Targets

Basic information

Technical information

TDR Targets ID: 788967
Name: N-(4-bromophenyl)-1-pyridin-3-ylsulfonylpiper idine-4-carboxamide
MW: 424.312 | Formula: C17H18BrN3O3S
H donors: 1 H acceptors: 4 LogP: 2.02 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: O=C(C1CCN(CC1)S(=O)(=O)c1cccnc1)Nc1ccc(cc1)Br
InChi: 1S/C17H18BrN3O3S/c18-14-3-5-15(6-4-14)20-17(22)13-7-10-21(11-8-13)25(23,24)16-2-1-9-19-12-16/h1-6,9,12-13H,7-8,10-11H2,(H,20,22)
InChiKey: RENUYUFYXGUQDV-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-bromophenyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide
N-(4-bromophenyl)-1-(3-pyridylsulfonyl)-4-piperidinecarboxamide
N-(4-bromophenyl)-1-(3-pyridylsulfonyl)isonipecotamide
N-(4-bromophenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

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 tuberculosis	Probable aminotransferase	0.016	0.2879	0.6588
Echinococcus granulosus	SAM and MBT domain containing protein	0.0047	0.0417	0.0386
Mycobacterium tuberculosis	Probable dehydrogenase	0.0105	0.1677	0.3678
Brugia malayi	beta-lactamase	0.0035	0.0157	0.0157
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0157	0.0157
Trypanosoma brucei	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0034	0.0141	0.3585
Leishmania major	trypanothione reductase	0.0046	0.0393	1
Loa Loa (eye worm)	thioredoxin reductase	0.0046	0.0393	0.0393
Echinococcus granulosus	thioredoxin glutathione reductase	0.0046	0.0393	0.0353
Echinococcus multilocularis	polycomb protein SCMH1	0.0047	0.0417	0.0386
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0047	0.0417	0.6687
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0105	0.1677	0.3678
Trypanosoma brucei	hypothetical protein, conserved	0.0035	0.0157	0.4003
Entamoeba histolytica	hypothetical protein	0.0041	0.0276	0.5
Plasmodium vivax	glutathione reductase, putative	0.0046	0.0393	1
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0035	0.0157	0.0157
Schistosoma mansoni	sex comb on midleg homolog	0.0047	0.0417	0.0474
Mycobacterium tuberculosis	Probable oxidoreductase	0.0117	0.1932	0.4296
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.0186	0.3433	0.4614
Trypanosoma cruzi	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0034	0.0141	0.3585
Mycobacterium leprae	PROBABLE ADENOSYLMETHIONINE-8-AMINO-7-OXONONANOATE AMINOTRANSFERASE BIOA	0.016	0.2879	1
Echinococcus granulosus	geminin	0.0166	0.2998	0.4004
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0417	0.0417
Echinococcus granulosus	histone acetyltransferase MYST2	0.0054	0.0559	0.0585
Loa Loa (eye worm)	cytochrome P450 family protein	0.0104	0.1663	0.1663
Onchocerca volvulus		0.0053	0.0545	1
Mycobacterium ulcerans	adenosylmethionine-8-amino-7-oxononanoate aminotransferase	0.016	0.2879	1
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0046	0.0393	0.0353
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.0186	0.3433	0.4614
Loa Loa (eye worm)	cytochrome P450 family protein	0.0044	0.034	0.034
Brugia malayi	hypothetical protein	0.0041	0.0276	0.0276
Toxoplasma gondii	ABC1 family protein	0.0035	0.0157	0.4003
Echinococcus granulosus	tumor protein p63	0.0362	0.7277	1
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0054	0.0559	0.0585
Brugia malayi	mbt repeat family protein	0.0047	0.0417	0.0417
Echinococcus multilocularis	tumor protein p63	0.0362	0.7277	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0234	0.4479	0.4479
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0157	0.0157
Plasmodium vivax	thioredoxin reductase, putative	0.0046	0.0393	1
Loa Loa (eye worm)	MBCTL1	0.0054	0.0559	0.0559
Leishmania major	hypothetical protein, conserved	0.0035	0.0157	0.4003
Plasmodium falciparum	FAD-linked sulfhydryl oxidase ERV1, putative	0.0034	0.0141	0.3585
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0157	0.0157
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0117	0.1932	0.4296
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0034	0.0141	0.3585
Brugia malayi	Cytochrome P450 family protein	0.0044	0.034	0.034
Loa Loa (eye worm)	CYP4Cod1	0.0044	0.034	0.034
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0041	0.0276	0.019
Loa Loa (eye worm)	beta-lactamase	0.0035	0.0157	0.0157
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0117	0.1932	0.4296
Loa Loa (eye worm)	hepatopoietin HPO2	0.0034	0.0141	0.0141
Brugia malayi	beta-lactamase family protein	0.0035	0.0157	0.0157
Brugia malayi	glutathione reductase	0.0046	0.0393	0.0393
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0234	0.4479	0.6079
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0157	0.0157
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0054	0.0559	0.0585
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0054	0.0559	0.0559
Trypanosoma cruzi	cytochrome P450, putative	0.0044	0.034	0.8663
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0545	0.0545
Echinococcus multilocularis	geminin	0.0166	0.2998	0.4004
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.0157	0.4003
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0105	0.1677	0.5583
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0105	0.1677	0.3678
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0157	0.0157
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0044	0.034	0.0673
Brugia malayi	mbt repeat family protein	0.0047	0.0417	0.0417
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0047	0.0417	0.0386
Loa Loa (eye worm)	mbt repeat family protein	0.0047	0.0417	0.0417
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0117	0.1932	0.652
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0234	0.4479	0.6079
Loa Loa (eye worm)	cytochrome P450 family protein	0.0044	0.034	0.034
Toxoplasma gondii	Erv1 / Alr family protein	0.0034	0.0141	0.3585
Schistosoma mansoni	sex comb on midleg homolog	0.0047	0.0417	0.0474
Schistosoma mansoni	cellular tumor antigen P53	0.0053	0.0545	0.0709
Echinococcus granulosus	polycomb protein SCMH1	0.0047	0.0417	0.0386
Entamoeba histolytica	hypothetical protein	0.0041	0.0276	0.5
Mycobacterium tuberculosis	Probable reductase	0.0105	0.1677	0.3678
Mycobacterium tuberculosis	Adenosylmethionine-8-amino-7-oxononanoate aminotransferase BioA	0.016	0.2879	0.6588
Trypanosoma cruzi	trypanothione reductase, putative	0.0046	0.0393	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0559	0.0559
Mycobacterium ulcerans	hypothetical protein	0.016	0.2879	1
Brugia malayi	Cytochrome P450 family protein	0.0044	0.034	0.034
Entamoeba histolytica	hypothetical protein	0.0041	0.0276	0.5
Brugia malayi	Augmenter of liver regeneration	0.0034	0.0141	0.0141
Plasmodium vivax	FAD-linked sulfhydryl oxidase ERV1, putative	0.0034	0.0141	0.3585
Schistosoma mansoni	hypothetical protein	0.0166	0.2998	0.5194
Schistosoma mansoni	transcription factor LCR-F1	0.0041	0.0276	0.0218
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0487	1	1
Toxoplasma gondii	thioredoxin reductase	0.0046	0.0393	1
Schistosoma mansoni	hypothetical protein	0.0166	0.2998	0.5194
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0157	0.0157
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0234	0.4479	0.6079
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0054	0.0559	0.0585
Trichomonas vaginalis	acetylornithine aminotransferase, putative	0.016	0.2879	1
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0105	0.1677	0.3678
Brugia malayi	Thioredoxin reductase	0.0046	0.0393	0.0393
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0234	0.4479	0.7902
Plasmodium falciparum	glutathione reductase	0.0046	0.0393	1
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0054	0.0559	0.0734
Trypanosoma brucei	cytochrome P450, putative	0.0044	0.034	0.8663
Schistosoma mansoni	hypothetical protein	0.0286	0.5627	1
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0034	0.0141	0.3585
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0234	0.4479	0.4479
Brugia malayi	beta-lactamase family protein	0.0035	0.0157	0.0157
Leishmania major	hypothetical protein, conserved	0.0034	0.0141	0.3585
Schistosoma mansoni	hypothetical protein	0.0041	0.0276	0.0218
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0035	0.0157	0.0157
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0234	0.4479	0.6079
Entamoeba histolytica	hypothetical protein	0.0041	0.0276	0.5
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0047	0.0417	0.0474
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0225	0.4288	1
Plasmodium falciparum	thioredoxin reductase	0.0046	0.0393	1
Brugia malayi	Cytochrome P450 family protein	0.0104	0.1663	0.1663
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0035	0.0157	0.0023
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0105	0.1677	0.3678
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0234	0.4479	0.7902
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0234	0.4479	0.7902
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0046	0.0393	0.057
Loa Loa (eye worm)	glutathione reductase	0.0046	0.0393	0.0393
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.0157	0.4003
Trypanosoma brucei	trypanothione reductase	0.0046	0.0393	1
Onchocerca volvulus		0.0047	0.0417	0.6687
Echinococcus granulosus	beta LACTamase domain containing family member	0.0035	0.0157	0.0023
Plasmodium vivax	hypothetical protein, conserved	0.0035	0.0157	0.4003
Leishmania major	cytochrome p450-like protein	0.0044	0.034	0.8663
Trypanosoma cruzi	cytochrome P450, putative	0.0044	0.034	0.8663
Toxoplasma gondii	Erv1 / Alr family protein	0.0034	0.0141	0.3585
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0041	0.0276	0.019

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 788967