TDR Targets

Basic information

Technical information

TDR Targets ID: 409881
Name: (2S)-2-amino-N-hydroxy-2-(4-hydroxyphenyl)ace tamide
MW: 182.177 | Formula: C8H10N2O3
H donors: 4 H acceptors: 3 LogP: -0.52 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: ONC(=O)[C@H](c1ccc(cc1)O)N
InChi: 1S/C8H10N2O3/c9-7(8(12)10-13)5-1-3-6(11)4-2-5/h1-4,7,11,13H,9H2,(H,10,12)/t7-/m0/s1
InChiKey: CGHJCSRMNSHBQI-ZETCQYMHSA-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

(2S)-2-amino-2-(4-hydroxyphenyl)ethanehydroxamic acid
(2S)-2-azanyl-N-hydroxy-2-(4-hydroxyphenyl)ethanamide
(2S)-2-amino-N-hydroxy-2-(4-hydroxyphenyl)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
Loa Loa (eye worm)	DNA polymerase epsilon catalytic subunit	0.0042	0.0023	0.0092
Leishmania major	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	0.0836	0.4354	0.4354
Trypanosoma brucei	DNA polymerase eta, putative	0.0062	0.0134	0.0134
Echinococcus granulosus	DNA polymerase zeta catalytic subunit	0.0094	0.0307	0.0704
Trichomonas vaginalis	DNA polymerase II, putative	0.0148	0.0603	0.1384
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0092	0.03	0.069
Mycobacterium ulcerans	hypothetical protein	0.0986	0.5171	1
Trypanosoma cruzi	DNA polymerase I alpha catalytic subunit, putative	0.0148	0.0603	0.0603
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0886	0.4625	0.4625
Schistosoma mansoni	jumonji domain containing protein	0.0073	0.0197	0.0452
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0263	0.1231	0.1231
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.1872	1	1
Schistosoma mansoni	DNA polymerase epsilon catalytic subunit	0.0094	0.0307	0.0704
Brugia malayi	DNA polymerase family B containing protein	0.0094	0.0307	0.1211
Trypanosoma brucei	DNA polymerase alpha catalytic subunit	0.0148	0.0603	0.0603
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.1872	1	1
Echinococcus multilocularis	DNA polymerase alpha catalytic subunit	0.0339	0.1643	0.3774
Trichomonas vaginalis	glucosylceramidase, putative	0.0329	0.1592	0.3656
Trypanosoma cruzi	DNA polymerase epsilon catalytic subunit, putative	0.0094	0.0307	0.0307
Trypanosoma cruzi	DNA polymerase delta catalytic subunit, putative	0.0094	0.0307	0.0307
Trypanosoma brucei	DNA polymerase delta catalytic subunit, putative	0.0094	0.0307	0.0307
Loa Loa (eye worm)	hypothetical protein	0.0062	0.0134	0.0531
Onchocerca volvulus	DNA polymerase alpha catalytic subunit homolog	0.0466	0.2335	1
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0986	0.5171	1
Echinococcus multilocularis	DNA polymerase delta catalytic subunit	0.0094	0.0307	0.0704
Entamoeba histolytica	DNA repair and recombination protein, putative	0.0836	0.4354	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0502	0.2532	0.5817
Entamoeba histolytica	hypothetical protein, conserved	0.0836	0.4354	1
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0263	0.1231	0.1231
Trichomonas vaginalis	DNA polymerase zeta catalytic subunit, putative	0.0094	0.0307	0.0704
Giardia lamblia	DNA polymerase epsilon, catalytic subunit	0.0094	0.0307	0.0704
Onchocerca volvulus	Glucosylceramidase homolog	0.0329	0.1592	0.6335
Echinococcus granulosus	DNA polymerase alpha catalytic subunit	0.0339	0.1643	0.3774
Trichomonas vaginalis	glucosylceramidase, putative	0.0329	0.1592	0.3656
Trichomonas vaginalis	conserved hypothetical protein	0.0836	0.4354	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0502	0.2532	0.5817
Echinococcus granulosus	ATP dependent DNA helicase PIF1	0.0836	0.4354	1
Brugia malayi	jmjC domain containing protein	0.0092	0.03	0.1185
Plasmodium vivax	DNA polymerase alpha, putative	0.0275	0.1294	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0201	0.0895	0.3533
Trypanosoma cruzi	DNA polymerase eta, putative	0.0062	0.0134	0.0134
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF7, putative	0.0836	0.4354	0.4354
Loa Loa (eye worm)	hypothetical protein	0.0052	0.008	0.0314
Echinococcus multilocularis	dna polymerase epsilon catalytic subunit a	0.0094	0.0307	0.0704
Trypanosoma cruzi	DNA polymerase zeta catalytic subunit, putative	0.0042	0.0023	0.0023
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0502	0.2532	1
Toxoplasma gondii	DNA polymerase	0.0094	0.0307	0.1997
Echinococcus multilocularis	DNA polymerase zeta catalytic subunit	0.0094	0.0307	0.0704
Trichomonas vaginalis	glucosylceramidase, putative	0.0329	0.1592	0.3656
Trichomonas vaginalis	glucosylceramidase, putative	0.0502	0.2532	0.5817
Trypanosoma cruzi	DNA polymerase epsilon catalytic subunit, putative	0.0094	0.0307	0.0307
Trichomonas vaginalis	glucosylceramidase, putative	0.0502	0.2532	0.5817
Loa Loa (eye worm)	hypothetical protein	0.0052	0.008	0.0314
Entamoeba histolytica	DNA polymerase alpha catalytic subunit, putative	0.0096	0.0319	0.0734
Schistosoma mansoni	DNA polymerase alpha catalytic subunit	0.0127	0.0488	0.1121
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.1872	1	1
Trypanosoma brucei	DNA polymerase zeta catalytic subunit, putative	0.0094	0.0307	0.0307
Toxoplasma gondii	DNA polymerase (pol2) superfamily protein	0.0275	0.1294	0.896
Loa Loa (eye worm)	DNA polymerase epsilon catalytic subunit	0.0052	0.008	0.0314
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0321	0.1545	0.1545
Schistosoma mansoni	hypothetical protein	0.0165	0.0697	0.1602
Trichomonas vaginalis	glucosylceramidase, putative	0.0347	0.1688	0.3878
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.0886	0.4625	0.4625
Toxoplasma gondii	hypothetical protein	0.0302	0.1442	1
Brugia malayi	DNA polymerase delta catalytic subunit	0.0094	0.0307	0.1211
Trichomonas vaginalis	glucosylceramidase, putative	0.0329	0.1592	0.3656
Leishmania major	DNA polymerase zeta catalytic subunit, putative	0.0042	0.0023	0.0023
Echinococcus granulosus	jumonji domain containing protein	0.0039	0.001	0.0024
Trichomonas vaginalis	DNA polymerase delta catalytic subunit, putative	0.0094	0.0307	0.0704
Trichomonas vaginalis	glucosylceramidase, putative	0.0502	0.2532	0.5817
Trichomonas vaginalis	set domain proteins, putative	0.0229	0.1046	0.2403
Loa Loa (eye worm)	jmjC domain-containing protein	0.0058	0.0114	0.045
Leishmania major	DNA polymerase I alpha catalytic subunit, putative	0.0148	0.0603	0.0603
Echinococcus granulosus	geminin	0.0165	0.0697	0.1602
Brugia malayi	Pre-SET motif family protein	0.0201	0.0895	0.3533
Trichomonas vaginalis	glucosylceramidase, putative	0.0502	0.2532	0.5817
Schistosoma mansoni	hypothetical protein	0.0836	0.4354	1
Echinococcus multilocularis	geminin	0.0165	0.0697	0.1602
Loa Loa (eye worm)	hypothetical protein	0.0048	0.006	0.0237
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0023	0.0092
Schistosoma mansoni	DNA polymerase alpha catalytic subunit	0.0339	0.1643	0.3774
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.0886	0.4625	0.4625
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0263	0.1231	0.1231
Leishmania major	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	0.0836	0.4354	0.4354
Echinococcus granulosus	dna polymerase epsilon catalytic subunit a	0.0094	0.0307	0.0704
Plasmodium falciparum	DNA polymerase delta catalytic subunit	0.0094	0.0307	0.9569
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF7, putative	0.0836	0.4354	0.4354
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0092	0.03	0.069
Trypanosoma brucei	DNA repair and recombination helicase protein PIF6	0.0836	0.4354	0.4354
Trichomonas vaginalis	glucosylceramidase, putative	0.0329	0.1592	0.3656
Entamoeba histolytica	DNA polymerase zeta catalytic subunit, putative	0.0042	0.0023	0.0054
Leishmania major	DNA polymerase delta catalytic subunit, putative	0.0094	0.0307	0.0307
Trichomonas vaginalis	glucosylceramidase, putative	0.0329	0.1592	0.3656
Trichomonas vaginalis	DNA polymerase alpha catalytic subunit, putative	0.0148	0.0603	0.1384
Trichomonas vaginalis	DNA polymerase alpha catalytic subunit, putative	0.0052	0.008	0.0183
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.0023	0.0054
Brugia malayi	DNA polymerase alpha catalytic subunit	0.0275	0.1294	0.5111
Brugia malayi	DNA polymerase family B, exonuclease domain containing protein	0.0094	0.0307	0.1211
Echinococcus granulosus	dna polymerase eta	0.0062	0.0134	0.0309
Trypanosoma cruzi	DNA polymerase delta catalytic subunit, putative	0.0042	0.0023	0.0023
Trypanosoma brucei	DNA polymerase epsilon catalytic subunit, putative	0.0094	0.0307	0.0307
Loa Loa (eye worm)	hypothetical protein	0.0466	0.2335	0.9221
Schistosoma mansoni	DNA polymerase zeta catalytic subunit	0.0094	0.0307	0.0704
Onchocerca volvulus		0.0229	0.1046	0.3647
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF6, putative	0.0836	0.4354	0.4354
Trichomonas vaginalis	DNA polymerase alpha catalytic subunit, putative	0.0094	0.0307	0.0704
Leishmania major	DNA polymerase eta, putative	0.0062	0.0134	0.0134
Brugia malayi	ImpB/MucB/SamB family protein	0.0062	0.0134	0.0531
Schistosoma mansoni	DNA polymerase eta	0.0062	0.0134	0.0309
Plasmodium falciparum	DNA polymerase epsilon catalytic subunit A, putative	0.0052	0.008	0.19
Schistosoma mansoni	DNA polymerase delta catalytic subunit	0.0094	0.0307	0.0704
Leishmania major	DNA polymerase epsilon catalytic subunit, putative	0.0094	0.0307	0.0307
Echinococcus multilocularis	dna polymerase eta	0.0062	0.0134	0.0309
Echinococcus multilocularis	ATP dependent DNA helicase PIF1	0.0836	0.4354	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0023	0.0092
Entamoeba histolytica	DNA polymerase delta catalytic subunit, putative	0.0094	0.0307	0.0704
Echinococcus granulosus	DNA polymerase delta catalytic subunit	0.0094	0.0307	0.0704
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0502	0.2532	1
Plasmodium falciparum	DNA polymerase alpha catalytic subunit A	0.0096	0.0319	1
Toxoplasma gondii	DNA polymerase family B protein	0.0094	0.0307	0.1997
Giardia lamblia	DNA polymerase delta, catalytic subunit	0.0094	0.0307	0.0704
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0785	0.4075	0.9361
Echinococcus multilocularis	jumonji domain containing protein	0.0039	0.001	0.0024
Giardia lamblia	DNA polymerase alpha subunit A	0.0287	0.136	0.3124
Trypanosoma brucei	DNA polymerase beta thumb, putative	0.0263	0.1231	0.1231
Trypanosoma brucei	DNA repair and recombination helicase protein PIF7	0.0836	0.4354	0.4354
Trichomonas vaginalis	glucosylceramidase, putative	0.0329	0.1592	0.3656
Loa Loa (eye worm)	DNA-directed DNA polymerase III	0.0094	0.0307	0.1211
Schistosoma mansoni	hypothetical protein	0.0165	0.0697	0.1602
Trichomonas vaginalis	glucosylceramidase, putative	0.0347	0.1688	0.3878
Giardia lamblia	Rrm3p helicase	0.0836	0.4354	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 57 uM	Inhibition of CSK measured as poly-E4Y phosphorylation by acid precipitation assay in presence of 0.2 mM CoCl2	ChEMBL.	17149882
IC50 (functional)	= 57 uM	Inhibition of CSK measured as poly-E4Y phosphorylation by acid precipitation assay in presence of 0.2 mM CoCl2	ChEMBL.	17149882

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

PubChem: 16094824

Bibliographic References

1 literature reference was collected for this gene.

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

Detailed information for compound 409881