TDR Targets

Basic information

Technical information

TDR Targets ID: 1071800
Name: 2-chloro-N-[[(5S)-3-[3-fluoro-4-[4-[(5-nitrof uran-2-yl)methyl]piperazin-1-yl]phenyl]-2-oxo -1,3-oxazolidin-5-yl]methyl]acetamide
MW: 495.889 | Formula: C21H23ClFN5O6
H donors: 1 H acceptors: 4 LogP: 2.25 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: ClCC(=O)NC[C@@H]1OC(=O)N(C1)c1ccc(c(c1)F)N1CCN(CC1)Cc1ccc(o1)[N+](=O)[O-]
InChi: 1S/C21H23ClFN5O6/c22-10-19(29)24-11-16-13-27(21(30)34-16)14-1-3-18(17(23)9-14)26-7-5-25(6-8-26)12-15-2-4-20(33-15)28(31)32/h1-4,9,16H,5-8,10-13H2,(H,24,29)/t16-/m0/s1
InChiKey: DEHQURMMRCBNIW-INIZCTEOSA-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

2-chloro-N-[[(5S)-3-[3-fluoro-4-[4-[(5-nitro-2-furyl)methyl]piperazin-1-yl]phenyl]-2-oxo-oxazolidin-5-yl]methyl]acetamide
2-chloro-N-[[(5S)-3-[3-fluoro-4-[4-[(5-nitro-2-furyl)methyl]-1-piperazinyl]phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide
2-chloro-N-[[(5S)-3-[3-fluoro-4-[4-[(5-nitro-2-furyl)methyl]piperazin-1-yl]phenyl]-2-keto-oxazolidin-5-yl]methyl]acetamide
2-chloro-N-[[(5S)-3-[3-fluoro-4-[4-[(5-nitrofuran-2-yl)methyl]piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]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
Schistosoma mansoni	hypothetical protein	0.0045	0.0389	0.0819
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0176	0.0372
Brugia malayi	ecdysteroid receptor	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0006	0.0013
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0176	0.0372
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0089	0.0188
Onchocerca volvulus		0.0011	0.0006	0.0032
Leishmania major	guanosine monophosphate reductase	0.0429	0.4741	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0101	0.0214
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0006	0.0006
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0011	0.0006	0.0013
Mycobacterium leprae	Probable inosine-5'-monophosphate dehydrogenase GuaB2 (IMP dehydrogenase) (IMPDH) (IMPD)	0.0429	0.4741	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0006	0.0013
Mycobacterium leprae	PROBABLE INOSINE-5'-MONOPHOSPHATE DEHYDROGENASE GUAB1(IMP DEHYDROGENASE) (IMPDH) (IMPD)	0.0195	0.2095	0.4418
Echinococcus granulosus	Niemann Pick C1 protein	0.0155	0.1636	0.3451
Brugia malayi	Nuclear hormone receptor-like 1	0.0011	0.0006	0.0013
Onchocerca volvulus	Protein ultraspiracle homolog	0.0011	0.0006	0.0032
Echinococcus granulosus	expressed conserved protein	0.0102	0.1034	0.2182
Brugia malayi	nuclear hormone receptor	0.0011	0.0006	0.0013
Mycobacterium ulcerans	inosine 5'-monophosphate dehydrogenase	0.0429	0.4741	1
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.002	0.0101	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0006	0.0013
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0026	0.0176	0.0372
Brugia malayi	inosine-5'-monophosphate dehydrogenase	0.0185	0.1975	0.4166
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0011	0.0006	0.0013
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.002	0.0101	0.0214
Schistosoma mansoni	hypothetical protein	0.0045	0.0389	0.0819
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0108	0.1109	0.2339
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0011	0.0006	0.0013
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0011	0.0006	0.0013
Schistosoma mansoni	RAR-like nuclear receptor	0.0011	0.0006	0.0013
Schistosoma mansoni	coup transcription factor	0.0011	0.0006	0.0013
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0006	0.0013
Toxoplasma gondii	IMP dehydrogenas	0.0429	0.4741	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0006	0.0013
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0006	0.0013
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0011	0.0006	0.0013
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0011	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.002	0.0101	0.0214
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0011	0.0006	0.0013
Echinococcus multilocularis	expressed conserved protein	0.0102	0.1034	0.1034
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0026	0.0176	0.0372
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0176	0.0372
Schistosoma mansoni	hypothetical protein	0.0045	0.0389	0.0819
Brugia malayi	CHE-14 protein	0.0047	0.0408	0.086
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0006	0.0013
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0011	0.0006	0.0006
Echinococcus multilocularis	Niemann Pick C1 protein	0.0155	0.1636	0.1636
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.002	0.0101	0.0214
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0047	0.0408	0.086
Loa Loa (eye worm)	steroid hormone receptor	0.0011	0.0006	0.0013
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0011	0.0006	0.0006
Wolbachia endosymbiont of Brugia malayi	IMP dehydrogenase	0.0429	0.4741	1
Trypanosoma brucei	GMP reductase	0.0429	0.4741	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0011	0.0006	0.0006
Onchocerca volvulus	Putative GMP reductase	0.0185	0.1975	1
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0011	0.0006	0.0006
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0011	0.0006	0.0013
Echinococcus multilocularis	sterol regulatory element binding protein	0.0047	0.0408	0.0408
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.0006	0.0013
Mycobacterium tuberculosis	Probable inosine-5'-monophosphate dehydrogenase GuaB2 (imp dehydrogenase) (inosinic acid dehydrogenase) (inosinate dehydrogenase	0.0429	0.4741	1
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0176	0.0372
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0011	0.0006	0.0013
Schistosoma mansoni	hypothetical protein	0.0045	0.0389	0.0819
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0176	0.0372
Echinococcus multilocularis	FTZ F1 alpha	0.0011	0.0006	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0006	0.0013
Schistosoma mansoni	retinoic acid receptor RXR	0.0011	0.0006	0.0013
Brugia malayi	nuclear receptor NHR-88	0.0011	0.0006	0.0013
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0176	0.0372
Brugia malayi	Niemann-Pick C1 protein precursor	0.0108	0.1109	0.2339
Echinococcus granulosus	ecdysone induced protein 78C	0.0011	0.0006	0.0013
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0089	0.0188
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0176	0.0372
Onchocerca volvulus	Bile acid receptor homolog	0.0011	0.0006	0.0032
Echinococcus multilocularis	protein dispatched 1	0.0053	0.0482	0.0482
Loa Loa (eye worm)	hypothetical protein	0.002	0.0101	0.0214
Brugia malayi	inosine-5'-monophosphate dehydrogenase	0.0185	0.1975	0.4166
Brugia malayi	Steroid receptor seven-up type 2	0.0011	0.0006	0.0013
Schistosoma mansoni	nuclear hormone receptor	0.0011	0.0006	0.0013
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.011	0.1128	0.2379
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0011	0.0006	0.0013
Echinococcus multilocularis	ecdysone induced protein 78C	0.0011	0.0006	0.0006
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0011	0.0006	0.0013
Brugia malayi	steroid hormone receptor	0.0011	0.0006	0.0013
Echinococcus granulosus	FTZ F1 alpha	0.0011	0.0006	0.0013
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0176	0.0372
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0026	0.0176	0.0372
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0176	0.0372
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0026	0.0176	0.0372
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0026	0.0176	0.0372
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0176	0.0372
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0011	0.0006	0.0013
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0011	0.0006	0.0013
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0011	0.0006	0.0013
Trypanosoma cruzi	inosine-5'-monophosphate dehydrogenase, putative	0.0429	0.4741	1
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0006	0.0013
Brugia malayi	photoreceptor-specific nuclear receptor	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0006	0.0013
Plasmodium vivax	inosine-5'-monophosphate dehydrogenase, putative	0.0418	0.4621	1
Plasmodium falciparum	inosine-5'-monophosphate dehydrogenase	0.0418	0.4621	1
Loa Loa (eye worm)	hypothetical protein	0.0057	0.0526	0.111
Echinococcus multilocularis	Niemann Pick C1 protein	0.0108	0.1109	0.1109
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0176	0.0372
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0011	0.0006	0.0013
Trypanosoma cruzi	inosine-5'-monophosphate dehydrogenase, putative	0.0429	0.4741	1
Onchocerca volvulus		0.0026	0.0176	0.0892
Schistosoma mansoni	patched 1	0.0047	0.0408	0.086
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.0006	0.0013
Leishmania major	inosine-5-monophosphate dehydrogenase	0.0429	0.4741	1
Mycobacterium leprae	Probable inosine-5'-monophosphate dehydrogenase GuaB3 (IMP dehydrogenase 2) (inosinic acid dehydrogenase) (inosinate dehydrogena	0.0234	0.2527	0.5329
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0176	0.0372
Trichomonas vaginalis	conserved hypothetical protein	0.0047	0.0408	0.5
Mycobacterium ulcerans	hypothetical protein	0.0026	0.0176	0.0372
Echinococcus granulosus	inosine 5' monophosphate dehydrogenase 2	0.0429	0.4741	1
Brugia malayi	GMP reductase	0.0185	0.1975	0.4166
Brugia malayi	inosine-5'-monophosphate dehydrogenase family protein	0.0429	0.4741	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0408	0.086
Loa Loa (eye worm)	hypothetical protein	0.002	0.0101	0.0214
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0006	0.0013
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0089	0.0188
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0006	0.0013
Mycobacterium ulcerans	inosine 5-monophosphate dehydrogenase	0.0418	0.4621	0.9747
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0011	0.0006	0.0013
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0006	0.0013
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0011	0.0006	0.0032
Mycobacterium ulcerans	inosine 5-monophosphate dehydrogenase	0.0195	0.2095	0.4418
Echinococcus granulosus	Protein patched homolog 1	0.0047	0.0408	0.086
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0011	0.0006	0.0013
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0011	0.0006	0.0013
Trypanosoma brucei	inosine-5'-monophosphate dehydrogenase	0.0429	0.4741	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0006	0.0006
Schistosoma mansoni	inosine-5-monophosphate dehydrogenase	0.0429	0.4741	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0011	0.0006	0.0013
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0011	0.0006	0.0013
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0011	0.0006	0.0013
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0011	0.0006	0.0013
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0176	0.0372
Trypanosoma cruzi	GMP reductase	0.0429	0.4741	1
Loa Loa (eye worm)	IMP dehydrogenase 1	0.0429	0.4741	1
Echinococcus multilocularis	inosine 5' monophosphate dehydrogenase 2	0.0429	0.4741	0.4741
Echinococcus multilocularis	protein patched	0.0047	0.0408	0.0408
Trypanosoma cruzi	inosine-5'-monophosphate dehydrogenase, putative	0.0429	0.4741	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0089	0.0188
Echinococcus granulosus	Niemann Pick C1 protein	0.0108	0.1109	0.2339
Mycobacterium tuberculosis	Probable inosine-5'-monophosphate dehydrogenase GuaB3 (imp dehydrogenase) (inosinic acid dehydrogenase) (inosinate dehydrogenase	0.0234	0.2527	0.5329
Loa Loa (eye worm)	GMP reductase	0.0185	0.1975	0.4166
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.002	0.0101	0.0214
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0026	0.0176	0.0372
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0011	0.0006	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0006	0.0013
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0176	0.0372
Plasmodium falciparum	acyl-CoA synthetase	0.002	0.0101	0.0219
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0108	0.1109	1
Trypanosoma cruzi	GMP reductase	0.0429	0.4741	1
Echinococcus granulosus	sterol regulatory element binding protein	0.0047	0.0408	0.086

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

ChEMBL: CHEMBL570879

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1071800