Detailed information for compound 1555624

Basic information

Technical information
  • TDR Targets ID: 1555624
  • Name: N'-ethyl-N-(pyridin-4-ylmethyl)oxamide
  • MW: 207.229 | Formula: C10H13N3O2
  • H donors: 2 H acceptors: 3 LogP: 0.04 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCNC(=O)C(=O)NCc1ccncc1
  • InChi: 1S/C10H13N3O2/c1-2-12-9(14)10(15)13-7-8-3-5-11-6-4-8/h3-6H,2,7H2,1H3,(H,12,14)(H,13,15)
  • InChiKey: ZKTVDLXEYGUNMS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N'-ethyl-N-(4-pyridylmethyl)oxamide
  • N'-ethyl-N-(pyridin-4-ylmethyl)ethanediamide
  • BAS 00753424
  • N-Ethyl-N'-pyridin-4-ylmethyl-oxalamide
  • MLS000712029
  • SMR000281796
  • ZINC04798186

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
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus regulator of G protein signaling 7 0.0028 0.0549 0.0691
Echinococcus multilocularis beta adrenergic receptor kinase 0.0271 0.6673 0.8545
Echinococcus multilocularis expressed protein 0.0028 0.0549 0.0691
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0549 1
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0588 1
Schistosoma mansoni regulator of G protein signaling 0.0028 0.0549 0.0539
Brugia malayi Regulator of G protein signaling domain containing protein 0.0028 0.0549 0.0539
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0588 1
Echinococcus multilocularis regulator of G protein signaling 0.0028 0.0549 0.0691
Loa Loa (eye worm) hypothetical protein 0.0032 0.0645 0.0635
Schistosoma mansoni serine/threonine protein kinase 0.0271 0.6673 0.6669
Loa Loa (eye worm) hypothetical protein 0.0028 0.0549 0.0539
Trypanosoma brucei serine/threonine-protein kinase NRKB, putative 0.0007 0.001 0.0174
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.1084 0.1075
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0029 0.0566 0.0556
Brugia malayi Trypsin family protein 0.0032 0.0645 0.0635
Schistosoma mansoni ran 0.0022 0.0391 0.0381
Echinococcus granulosus GTP binding nuclear protein Ran 0.0022 0.0391 0.0488
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0028 0.0549 0.0691
Loa Loa (eye worm) RGS-3 protein 0.0028 0.0549 0.0539
Brugia malayi Trypsin family protein 0.0032 0.0645 0.0635
Trypanosoma brucei serine/threonine-protein kinase NrkA 0.0007 0.001 0.0174
Loa Loa (eye worm) trypsin family protein 0.0032 0.0645 0.0635
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0029 0.0566 0.0556
Echinococcus multilocularis regulator of G protein signaling 3 0.0028 0.0549 0.0691
Echinococcus multilocularis regulator of G protein signaling 7 0.0028 0.0549 0.0691
Loa Loa (eye worm) hypothetical protein 0.0032 0.0645 0.0635
Echinococcus granulosus transmembrane protease serine 3 0.0032 0.0645 0.0814
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0032 0.0645 0.0635
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0022 0.0391 0.665
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0549 1
Echinococcus multilocularis snurportin 1 0.0316 0.7807 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0028 0.0549 0.0539
Echinococcus multilocularis G protein coupled receptor kinase 1 0.0243 0.5966 0.7639
Trichomonas vaginalis ran, putative 0.0022 0.0391 0.7071
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.1084 0.1378
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0022 0.0391 0.6591
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.1084 0.1378
Brugia malayi hypothetical protein 0.0028 0.0549 0.0539
Schistosoma mansoni z-protein (S1r protein) 0.0028 0.0549 0.0539
Echinococcus granulosus beta-adrenergic receptor kinase 0.0271 0.6673 0.8545
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0028 0.0549 0.0539
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.0032 0.0645 0.0635
Brugia malayi hypothetical protein 0.0028 0.0549 0.0539
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0022 0.0391 0.0381
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Echinococcus multilocularis enteropeptidase 0.0032 0.0645 0.0814
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0391 0.872
Brugia malayi PXA domain containing protein 0.0028 0.0549 0.0539
Trypanosoma brucei Serine/threonine-protein kinase NEK21, putative 0.0007 0.001 0.0174
Schistosoma mansoni hypothetical protein 0.0316 0.7807 0.7805
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0316 0.7807 0.7805
Entamoeba histolytica hypothetical protein 0.0028 0.0549 1
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0549 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0403 1 1
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0022 0.0391 0.5
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0022 0.0391 0.0488
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.0032 0.0645 0.0814
Schistosoma mansoni axis inhibition protein axin 0.0028 0.0549 0.0539
Echinococcus granulosus snurportin 1 0.0316 0.7807 1
Schistosoma mansoni regulator of G protein signaling 0.0028 0.0549 0.0539
Schistosoma mansoni hypothetical protein 0.0032 0.0645 0.0635
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0049 0.1084 0.1075
Entamoeba histolytica hypothetical protein 0.0028 0.0549 1
Echinococcus granulosus enteropeptidase 0.0032 0.0645 0.0814
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Entamoeba histolytica hypothetical protein 0.0028 0.0549 1
Schistosoma mansoni importin beta-1 0.003 0.0588 0.0578
Onchocerca volvulus 0.0371 0.9197 0.9142
Entamoeba histolytica hypothetical protein 0.0024 0.0447 0.8109
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Loa Loa (eye worm) hypothetical protein 0.0028 0.0549 0.0539
Echinococcus granulosus glycoprotein Antigen 5 0.0032 0.0645 0.0814
Echinococcus multilocularis importin subunit beta 1 0.003 0.0588 0.0741
Plasmodium vivax importin-beta 2, putative 0.003 0.0588 1
Trypanosoma brucei rac serine-threonine kinase, putative 0.0007 0.001 0.0174
Loa Loa (eye worm) hypothetical protein 0.0032 0.0645 0.0635
Loa Loa (eye worm) hypothetical protein 0.0032 0.0645 0.0635
Brugia malayi A-kinase anchor protein 10, precursor 0.0028 0.0549 0.0539
Schistosoma mansoni hypothetical protein 0.0032 0.0645 0.0635
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0549 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0549 0.0539
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.0032 0.0645 0.0814
Echinococcus granulosus axis inhibition protein axin 0.0028 0.0549 0.0691
Echinococcus granulosus G protein coupled receptor kinase 1 0.0243 0.5966 0.7639
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Mycobacterium ulcerans hypothetical protein 0.0032 0.0645 0.5
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0032 0.0645 0.0635
Brugia malayi regulator of G-protein signaling egl-10 0.0028 0.0549 0.0539
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0028 0.0549 0.0691
Plasmodium falciparum importin beta, putative 0.003 0.0588 1
Echinococcus granulosus Regulator of G protein signaling 20 0.0028 0.0549 0.0691
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Echinococcus multilocularis axis inhibition protein axin 0.0028 0.0549 0.0691
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.0028 0.0549 1
Echinococcus granulosus importin subunit beta 1 0.003 0.0588 0.0741
Schistosoma mansoni ran 0.0022 0.0391 0.0381
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0588 1
Echinococcus multilocularis Regulator of G protein signaling 20 0.0028 0.0549 0.0691
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0032 0.0645 0.0635
Schistosoma mansoni regulator of G protein signaling 0.0028 0.0549 0.0539
Echinococcus granulosus regulator of G protein signaling 3 0.0028 0.0549 0.0691
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.1084 0.1378
Echinococcus granulosus regulator of G protein signaling 7 0.0028 0.0549 0.0691
Loa Loa (eye worm) hypothetical protein 0.0032 0.0645 0.0635
Echinococcus granulosus Mastin 0.0032 0.0645 0.0814
Echinococcus multilocularis regulator of G protein signaling 7 0.0028 0.0549 0.0691
Echinococcus multilocularis Mastin 0.0032 0.0645 0.0814
Schistosoma mansoni regulator of G protein signaling 0.0028 0.0549 0.0539
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0028 0.0549 0.0539
Loa Loa (eye worm) hypothetical protein 0.0028 0.0549 0.0539
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0271 0.6673 0.6669
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Echinococcus multilocularis transmembrane protease serine 3 0.0032 0.0645 0.0814
Brugia malayi Trypsin-like protease protein 5 0.0032 0.0645 0.0635
Echinococcus multilocularis regulator of G protein signaling 3 0.0028 0.0549 0.0691
Brugia malayi hypothetical protein 0.0032 0.0645 0.0635
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0032 0.0645 0.0635
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0022 0.0391 0.0381
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0022 0.0391 0.6591
Trypanosoma brucei NEK family Serine/threonine-protein kinase, putative 0.0007 0.001 0.0174
Brugia malayi regulator of G-protein signaling rgs-7 0.0028 0.0549 0.0539
Brugia malayi RNA, U transporter 1 0.0084 0.1964 0.1955
Brugia malayi Trypsin family protein 0.0032 0.0645 0.0635
Schistosoma mansoni regulator of G protein signaling 0.0028 0.0549 0.0539
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0549 1
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.0032 0.0645 0.0814
Echinococcus granulosus axis inhibition protein axin 0.0028 0.0549 0.0691
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.1084 0.1075
Loa Loa (eye worm) hypothetical protein 0.0028 0.0549 0.0539
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0447 0.8109
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0022 0.0391 0.872
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0447 0.8109
Echinococcus multilocularis axis inhibition protein axin 0.0028 0.0549 0.0691
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.1084 0.1378
Echinococcus granulosus regulator of G protein signaling 3 0.0028 0.0549 0.0691
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0403 1 1
Loa Loa (eye worm) hypothetical protein 0.0403 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0549 1
Schistosoma mansoni serine/threonine protein kinase 0.0029 0.0566 0.0556
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0447 0.8109
Loa Loa (eye worm) hypothetical protein 0.0403 1 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0588 0.0578
Onchocerca volvulus 0.0403 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.1084 0.1075
Schistosoma mansoni serine/threonine protein kinase 0.0271 0.6673 0.6669
Echinococcus granulosus expressed protein 0.0028 0.0549 0.0691
Trypanosoma brucei protein kinase, putative 0.0007 0.001 0.0174
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0032 0.0645 0.0635
Entamoeba histolytica Ran family GTPase 0.0022 0.0391 0.7071
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0022 0.0391 0.6591
Schistosoma mansoni cercarial elastase (S01 family) 0.0032 0.0645 0.0635
Brugia malayi PXA domain containing protein 0.0028 0.0549 0.0539
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.0032 0.0645 0.0814
Brugia malayi Importin beta-1 subunit 0.003 0.0588 0.0578
Loa Loa (eye worm) PXA domain-containing protein 0.0028 0.0549 0.0539
Leishmania major GTP-binding protein, putative 0.0022 0.0391 0.872
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0447 1
Leishmania major importin beta-1 subunit, putative 0.0024 0.0447 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0549 0.0539
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0049 0.1084 0.1075
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0028 0.0549 0.0539
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0032 0.0645 0.0635
Brugia malayi Regulator of G protein signaling domain containing protein 0.0028 0.0549 0.0539
Schistosoma mansoni axis inhibition protein axin 0.0028 0.0549 0.0539
Echinococcus multilocularis glycoprotein Antigen 5 0.0032 0.0645 0.0814

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) > 260 uM PUBCHEM_BIOASSAY: Luminescence Cell-Based Dose Retest to Identify Potentiators of Heat Shock Factor 1 (HSF1). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493224] ChEMBL. No reference
Potency (functional) 17.7828 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23

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

Bibliographic References

No literature references available for this target.

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