TDR Targets

Basic information

Technical information

TDR Targets ID: 690840
Name: N-(4-nitrophenyl)-2-[(5-pyridin-4-yl-1,3,4-ox adiazol-2-yl)sulfanyl]acetamide
MW: 357.344 | Formula: C15H11N5O4S
H donors: 1 H acceptors: 6 LogP: 1.92 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: O=C(Nc1ccc(cc1)[N+](=O)[O-])CSc1nnc(o1)c1ccncc1
InChi: 1S/C15H11N5O4S/c21-13(17-11-1-3-12(4-2-11)20(22)23)9-25-15-19-18-14(24-15)10-5-7-16-8-6-10/h1-8H,9H2,(H,17,21)
InChiKey: GOILBZJHZFLHDT-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-nitrophenyl)-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
N-(4-nitrophenyl)-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]acetamide
N-(4-nitrophenyl)-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide

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
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.001	0.0015	0.0015
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0197	0.4936
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.001	0.0015	0.0076
Onchocerca volvulus	Protein cycle homolog	0.0037	0.0352	0.6345
Plasmodium falciparum	basic transcription factor 3b, putative	0.0035	0.0325	0.0675
Schistosoma mansoni	single-minded	0.0016	0.0086	0.0358
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0023	0.018	0.018
Loa Loa (eye worm)	ICD-1 protein	0.0035	0.0325	0.1339
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0086	0.0545
Echinococcus multilocularis	geminin	0.0171	0.2002	0.2002
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0016	0.0086	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0197	0.0812
Schistosoma mansoni	zinc finger protein	0.0021	0.0144	0.0649
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0086	0.0545
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0496	0.2422
Trypanosoma cruzi	PAS-domain containing phosphoglycerate kinase, putative	0.0016	0.0086	0.0547
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.001	0.0015	0.0076
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.001	0.0015	0.0076
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.001	0.0015	0.0063
Loa Loa (eye worm)	hypothetical protein	0.001	0.0015	0.0063
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.0325	1
Loa Loa (eye worm)	hypothetical protein	0.0065	0.0692	0.2852
Loa Loa (eye worm)	steroid hormone receptor	0.001	0.0015	0.0063
Schistosoma mansoni	hypothetical protein	0.0171	0.2002	1
Plasmodium vivax	basic transcription factor 3b, putative	0.0035	0.0325	0.0675
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0011	0.0027	0.0027
Echinococcus multilocularis	isocitrate dehydrogenase	0.0016	0.0086	0.0086
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0205	0.2428	1
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0016	0.0086	0.0086
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0059	0.0625	0.312
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0061	0.0649	0.3189
Brugia malayi	hypothetical protein	0.0037	0.0352	0.1394
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0197	0.0313
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0049	0.0496	0.2044
Schistosoma mansoni	aryl hydrocarbon receptor nuclear translocator homolog (darnt)	0.0037	0.0352	0.1693
Echinococcus granulosus	cpg binding protein	0.0032	0.0291	0.1451
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.001	0.0015	0.0015
Echinococcus multilocularis	transcription factor btf3	0.0035	0.0325	0.0325
Toxoplasma gondii	NAC domain-containing protein	0.0035	0.0325	0.4687
Trypanosoma cruzi	PAS-domain containing phosphoglycerate kinase, putative	0.0016	0.0086	0.0547
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.0496	0.2479
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0197	0.2177
Echinococcus multilocularis	aryl hydrocarbon receptor	0.0053	0.0549	0.0549
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0017	0.0101	0.0433
Echinococcus granulosus	fetal alzheimer antigen falz	0.0023	0.018	0.0897
Brugia malayi	Latrophilin receptor protein 2	0.0065	0.0692	0.2807
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0035	0.032	0.1596
Echinococcus granulosus	geminin	0.0171	0.2002	1
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0016	0.0086	0.0547
Brugia malayi	Bromodomain containing protein	0.0037	0.0348	0.1379
Echinococcus granulosus	histone lysine methyltransferase setb	0.0017	0.0101	0.0506
Schistosoma mansoni	hypothetical protein	0.0065	0.0692	0.3409
Trypanosoma cruzi	STE group serine/threonine-protein kinase, putative	0.0016	0.0086	0.0547
Brugia malayi	latrophilin 2 splice variant baaae	0.014	0.1625	0.6671
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0086	0.0545
Onchocerca volvulus		0.0029	0.0247	0.4378
Leishmania major	protein kinase, putative	0.0016	0.0086	0.0547
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0205	0.2428	1
Mycobacterium leprae	PROBABLE NICOTINATE-NUCLEOTIDE ADENYLYLTRANSFERASE NADD (DEAMIDO-NAD(+) PYROPHOSPHORYLASE) (DEAMIDO-NAD(+) DIPHOSPHORYLASE) (NIC	0.0302	0.3629	1
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.001	0.0015	0.0076
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0015	0.0015
Brugia malayi	CXXC zinc finger family protein	0.0029	0.0247	0.0962
Echinococcus multilocularis	FTZ F1 alpha	0.001	0.0015	0.0015
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0205	0.2428	1
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0348	0.1434
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0016	0.0086	0.0545
Schistosoma mansoni	hypothetical protein	0.0065	0.0692	0.3409
Schistosoma mansoni	bromodomain containing protein	0.0063	0.0667	0.3283
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0348	0.1434
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0086	0.0086
Echinococcus granulosus	zinc finger protein	0.0021	0.0144	0.072
Echinococcus multilocularis	thyroid hormone receptor alpha	0.001	0.0015	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0205	0.2428	1
Schistosoma mansoni	aryl hydrocarbon receptor	0.0016	0.009	0.0374
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0016	0.0086	0.0355
Brugia malayi	aryl hydrocarbon receptor AHR-1	0.0037	0.0348	0.138
Schistosoma mansoni	cpg binding protein	0.0032	0.0291	0.1386
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.001	0.0015	0.0063
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0065	0.0692	0.0692
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0086	0.0355
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.0197	0.4936
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.032	0.1599
Mycobacterium ulcerans	bifunctional nicotinate-nucleotide adenylyltransferase NadD/hypothetical protein	0.0302	0.3629	0.5
Loa Loa (eye worm)	hypothetical protein	0.001	0.0015	0.0063
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0377	0.1553
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.001	0.0015	0.0063
Leishmania major	PAS-domain containing phosphoglycerate kinase, putative	0.0016	0.0086	0.0547
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0545	0.2246
Loa Loa (eye worm)	hypothetical protein	0.014	0.1625	0.6692
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0197	0.4936
Brugia malayi	hypothetical protein	0.0037	0.0348	0.138
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.001	0.0015	0.0063
Brugia malayi	hypothetical protein	0.0016	0.0088	0.0302
Brugia malayi	hypothetical protein	0.0025	0.0197	0.0754
Entamoeba histolytica	transcription factor BTF3, putative	0.0035	0.0325	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0496	0.2422
Schistosoma mansoni	hypothetical protein	0.0011	0.0027	0.0061
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.001	0.0015	0.0015
Brugia malayi	beta-NAC-like protein	0.0035	0.0325	0.1285
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.0496	0.0496
Brugia malayi	hypothetical protein	0.0035	0.032	0.1264
Schistosoma mansoni	cpg binding protein	0.0029	0.0247	0.1168
Brugia malayi	hypothetical protein	0.0053	0.0545	0.2197
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.0325	1
Schistosoma mansoni	cpg binding protein	0.0032	0.0291	0.1386
Echinococcus granulosus	Aryl hydrocarbon receptor nuclear	0.0016	0.009	0.0447
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0017	0.0093	0.0467
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.0325	1
Brugia malayi	PHD-finger family protein	0.0026	0.0208	0.0799
Brugia malayi	Helix-loop-helix DNA-binding domain containing protein	0.0037	0.0352	0.1394
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.001	0.0015	0.0076
Schistosoma mansoni	hypothetical protein	0.0035	0.032	0.1534
Loa Loa (eye worm)	hypothetical protein	0.001	0.0015	0.0063
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0049	0.0496	0.2479
Echinococcus granulosus	aryl hydrocarbon receptor	0.0053	0.0549	0.274
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.001	0.0015	0.0063
Onchocerca volvulus		0.0053	0.0545	1
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0017	0.0101	0.0101
Brugia malayi	aryl hydrocarbon receptor nuclear translocator protein, putative	0.0037	0.0352	0.1394
Echinococcus multilocularis	GPCR, family 2	0.0065	0.0692	0.0692
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.001	0.0015	0.0015
Echinococcus granulosus	GPCR family 2	0.0065	0.0692	0.3459
Loa Loa (eye worm)	PHD-finger family protein	0.002	0.0136	0.0561
Loa Loa (eye worm)	bromodomain containing protein	0.0017	0.0101	0.0415
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.032	0.032
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0065	0.0692	0.3459
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0029	0.0247	0.1019
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0035	0.032	0.032
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0348	0.1434
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0065	0.0692	0.2852
Leishmania major	hypothetical protein, conserved	0.0025	0.0197	0.4936
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0065	0.0692	0.3459
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.032	0.1534
Schistosoma mansoni	hypothetical protein	0.0171	0.2002	1
Loa Loa (eye worm)	hypothetical protein	0.0043	0.042	0.1731
Brugia malayi	Isocitrate dehydrogenase	0.0016	0.0086	0.0294
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0101	0.0417
Echinococcus multilocularis	ecdysone induced protein 78C	0.001	0.0015	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0349	0.1436
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0023	0.018	0.0827
Loa Loa (eye worm)	aryl Hydrocarbon receptor Associated protein family member	0.0053	0.0549	0.2259
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0015	0.0015
Loa Loa (eye worm)	hypothetical protein	0.001	0.0015	0.0063
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0049	0.0496	0.1994
Brugia malayi	Bromodomain containing protein	0.0074	0.0808	0.3285
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0015	0.0076
Schistosoma mansoni	hypothetical protein	0.002	0.0136	0.0609
Loa Loa (eye worm)	hypothetical protein	0.001	0.0015	0.0063
Brugia malayi	F/Y-rich N-terminus family protein	0.0011	0.0021	0.0026
Trypanosoma cruzi	STE group serine/threonine-protein kinase, putative	0.0016	0.0086	0.0547
Loa Loa (eye worm)	hypothetical protein	0.001	0.0015	0.0063
Echinococcus granulosus	transcription factor btf3	0.0035	0.0325	0.1624
Leishmania major	protein kinase, putative	0.0016	0.0086	0.0547
Plasmodium vivax	nicotinate-nucleotide adenylyltransferase, putative	0.0302	0.3629	1
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0016	0.0086	0.0357
Brugia malayi	isocitrate dehydrogenase	0.0016	0.0086	0.0294
Mycobacterium tuberculosis	Probable nicotinate-nucleotide adenylyltransferase NadD (deamido-NAD(+) pyrophosphorylase) (deamido-NAD(+) diphosphorylase) (nic	0.0302	0.3629	1
Schistosoma mansoni	zinc finger protein	0.0015	0.0072	0.0288
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0086	0.0086
Schistosoma mansoni	hypothetical protein	0.0065	0.0692	0.3409
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0197	0.0313
Echinococcus multilocularis	zinc finger protein	0.0021	0.0144	0.0144
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.001	0.0015	0.0063
Echinococcus multilocularis	cpg binding protein	0.0032	0.0291	0.0291
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0086	0.0086
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0049	0.0496	0.0496
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0065	0.0692	0.0692
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0017	0.0093	0.0093
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0057	0.0596	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0015	0.0076
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0017	0.0093	0.0394
Echinococcus granulosus	ecdysone induced protein 78C	0.001	0.0015	0.0076
Schistosoma mansoni	hypothetical protein	0.014	0.1625	0.8101
Treponema pallidum	hypothetical protein	0.0302	0.3629	0.5
Schistosoma mansoni	hypothetical protein	0.0065	0.0692	0.3409
Trypanosoma cruzi	transcription factor btf3, putative	0.0035	0.0325	1
Plasmodium falciparum	nicotinamide/nicotinic acid mononucleotide adenylyltransferase	0.0302	0.3629	1
Schistosoma mansoni	transcription factor btf3	0.0035	0.0325	0.156
Loa Loa (eye worm)	hypothetical protein	0.001	0.0015	0.0063
Brugia malayi	PAS domain containing protein	0.0016	0.0086	0.0294
Trypanosoma brucei	transcription factor BTF3, putative	0.0035	0.0325	1
Loa Loa (eye worm)	helix-loop-helix DNA-binding domain-containing protein	0.0037	0.0352	0.1448
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.0197	0.0313
Entamoeba histolytica	hypothetical protein	0.0035	0.0325	1
Schistosoma mansoni	hypothetical protein	0.0015	0.0072	0.0288
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0059	0.0625	0.0625
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0011	0.0027	0.0137
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0016	0.0086	0.0431
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0065	0.0692	0.2807
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0017	0.0093	0.0394
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0348	0.1434
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.001	0.0015	0.0063
Loa Loa (eye worm)	hypothetical protein	0.001	0.0015	0.0063
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0049	0.0496	0.2422
Leishmania major	basic transcription factor 3a, putative	0.0035	0.0325	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0017	0.0101	0.0433
Loa Loa (eye worm)	hypothetical protein	0.0068	0.0736	0.3032
Echinococcus granulosus	FTZ F1 alpha	0.001	0.0015	0.0076
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	0.0016	0.0086	0.5
Trypanosoma cruzi	transcription factor btf3, putative	0.0035	0.0325	1
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0016	0.0086	0.0545
Echinococcus multilocularis	Aryl hydrocarbon receptor nuclear	0.0016	0.009	0.009

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 690840