Detailed information for compound 1315679

Basic information

Technical information
  • TDR Targets ID: 1315679
  • Name: 5-chloro-N-ethyl-2-methoxybenzamide
  • MW: 213.661 | Formula: C10H12ClNO2
  • H donors: 1 H acceptors: 1 LogP: 2.17 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCNC(=O)c1cc(Cl)ccc1OC
  • InChi: 1S/C10H12ClNO2/c1-3-12-10(13)8-6-7(11)4-5-9(8)14-2/h4-6H,3H2,1-2H3,(H,12,13)
  • InChiKey: CYEVQZAXPSGVHC-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 5-chloro-N-ethyl-2-methoxy-benzamide
  • MLS000681158
  • SMR000269417
  • ZINC00453865

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lamin A/C Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723

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
Brugia malayi Amidase family protein 0.0026 0.0516 0.0433
Trichomonas vaginalis valacyclovir hydrolase, putative 0.008 0.3197 0.5
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0841 0.0762
Treponema pallidum aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0026 0.0516 0.5
Mycobacterium leprae POSSIBLE LYSOPHOSPHOLIPASE 0.008 0.3197 1
Echinococcus granulosus lamin 0.0033 0.0841 0.0841
Plasmodium falciparum lysophospholipase, putative 0.008 0.3197 1
Trichomonas vaginalis conserved hypothetical protein 0.008 0.3197 0.5
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.008 0.3197 0.5
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3197 0.5
Loa Loa (eye worm) hypothetical protein 0.0033 0.0841 0.0841
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0017 0.0086 0.0086
Plasmodium vivax PST-A protein 0.008 0.3197 1
Loa Loa (eye worm) amidase 0.0026 0.0516 0.0516
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3197 0.5
Trichomonas vaginalis conserved hypothetical protein 0.008 0.3197 0.5
Brugia malayi putative amidase 0.0026 0.0516 0.0433
Schistosoma mansoni lamin 0.0033 0.0841 0.0343
Echinococcus multilocularis musashi 0.0033 0.0841 0.0841
Onchocerca volvulus 0.0033 0.0841 0.5
Schistosoma mansoni intermediate filament proteins 0.0033 0.0841 0.0343
Trypanosoma cruzi monoglyceride lipase, putative 0.008 0.3197 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3197 0.5
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0841 0.0841
Echinococcus granulosus fatty acid amide hydrolase 1 0.0026 0.0516 0.0516
Mycobacterium tuberculosis Possible lysophospholipase 0.008 0.3197 1
Entamoeba histolytica hydrolase, alpha/beta fold family domain containing protein 0.008 0.3197 0.5
Onchocerca volvulus 0.0033 0.0841 0.5
Leishmania major monoglyceride lipase, putative 0.008 0.3197 1
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3197 0.5
Echinococcus multilocularis lamin dm0 0.0033 0.0841 0.0841
Echinococcus multilocularis lamin 0.0033 0.0841 0.0841
Plasmodium falciparum esterase, putative 0.008 0.3197 1
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0841 0.0841
Mycobacterium ulcerans hypothetical protein 0.008 0.3197 1
Plasmodium falciparum lysophospholipase, putative 0.008 0.3197 1
Brugia malayi Amidase family protein 0.0026 0.0516 0.0433
Echinococcus multilocularis glutamyl tRNA(Gln) amidotransferase subunit A 0.0026 0.0516 0.0516
Mycobacterium ulcerans lysophospholipase 0.008 0.3197 1
Trypanosoma brucei monoglyceride lipase, putative 0.008 0.3197 1
Plasmodium falciparum lysophospholipase, putative 0.008 0.3197 1
Echinococcus granulosus lamin dm0 0.0033 0.0841 0.0841
Loa Loa (eye worm) hypothetical protein 0.0032 0.0812 0.0812
Loa Loa (eye worm) amidase 0.0026 0.0516 0.0516
Chlamydia trachomatis glutamyl-tRNA(Gln) amidotransferase subunit A 0.0026 0.0516 0.5
Wolbachia endosymbiont of Brugia malayi aspartyl/glutamyl-tRNA amidotransferase subunit A 0.0026 0.0516 0.5
Trichomonas vaginalis Clan SC, family S33, methylesterase-like serine peptidase 0.008 0.3197 0.5
Echinococcus granulosus glutamyl tRNAGln amidotransferase subunit A 0.0026 0.0516 0.0516
Echinococcus multilocularis fatty acid amide hydrolase 1 0.0026 0.0516 0.0516
Echinococcus granulosus intermediate filament protein 0.0033 0.0841 0.0841
Trypanosoma brucei monoglyceride lipase, putative 0.008 0.3197 1
Schistosoma mansoni lamin 0.0033 0.0841 0.0343
Brugia malayi intermediate filament protein 0.0033 0.0841 0.0762

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.2512 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 11.6891 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: Inhibitors of TCP-1 ring complex (TRiC) of Methanococcus maripaludis (MmCpn): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488991] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum 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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