Detailed information for compound 1797153

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 310.475 | Formula: C18H34N2O2
  • H donors: 1 H acceptors: 1 LogP: 4.73 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCO/N=C\1/CCCCCCCCCCC(=O)NCCC1
  • InChi: 1S/C18H34N2O2/c1-2-16-22-20-17-12-9-7-5-3-4-6-8-10-14-18(21)19-15-11-13-17/h2-16H2,1H3,(H,19,21)/b20-17-
  • InChiKey: RIDILXJDPSBBQW-JZJYNLBNSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Brugia malayi Thioredoxin family protein 0.0468 0.2511 0.2511
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0086 0.0376 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0031 0.0069 0.0101
Plasmodium falciparum amino acid transporter, putative 0.0031 0.0069 0.1835
Echinococcus multilocularis protoporphyrinogen oxidase 0.0086 0.0376 0.1215
Loa Loa (eye worm) hypothetical protein 0.0031 0.0069 0.0069
Loa Loa (eye worm) hypothetical protein 0.0086 0.0376 0.0376
Onchocerca volvulus 0.0086 0.0376 0.0453
Loa Loa (eye worm) hypothetical protein 0.1235 0.6802 0.6802
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0086 0.0376 0.0558
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0086 0.0376 0.1215
Echinococcus granulosus GPCR family 2 0.0572 0.3091 1
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0031 0.0069 0.0101
Treponema pallidum sodium- and chloride- dependent transporter 0.0185 0.0926 1
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0031 0.0069 0.1835
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.0152 0.0152
Echinococcus granulosus sodium dependent neurotransmitter transporter 0.0031 0.0069 0.0223
Mycobacterium ulcerans oxidoreductase 0.0086 0.0376 0.0558
Schistosoma mansoni hypothetical protein 0.0468 0.2511 0.3692
Plasmodium falciparum transporter, putative 0.0031 0.0069 0.1835
Loa Loa (eye worm) hypothetical protein 0.0185 0.0926 0.0926
Echinococcus multilocularis serotonin transporter 0.0185 0.0926 0.2996
Trypanosoma cruzi UDP-galactopyranose mutase 0.0086 0.0376 1
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0185 0.0926 0.0926
Echinococcus multilocularis sodium and chloride dependent glycine 0.0031 0.0069 0.0223
Brugia malayi hypothetical protein 0.0086 0.0376 0.0376
Plasmodium vivax hypothetical protein, conserved 0.0031 0.0069 0.1835
Leishmania major alpha glucosidase II subunit, putative 0.0037 0.0098 0.2611
Schistosoma mansoni hypothetical protein 0.0572 0.3091 0.4545
Loa Loa (eye worm) norepinephrine transporter 0.0185 0.0926 0.0926
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0152 0.0224
Mycobacterium tuberculosis Conserved protein 0.0468 0.2511 0.4014
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0031 0.0069 0.0069
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0152 0.0224
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0086 0.0376 0.0552
Mycobacterium ulcerans hypothetical protein 0.0468 0.2511 0.3727
Echinococcus granulosus sodium:chloride dependent neurotransmitter 0.0031 0.0069 0.0223
Loa Loa (eye worm) hypothetical protein 0.0031 0.0069 0.0069
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0098 0.0391
Toxoplasma gondii hypothetical protein 0.0031 0.0069 0.1835
Chlamydia trachomatis protoporphyrinogen oxidase 0.0086 0.0376 1
Plasmodium vivax amine transporter, putative 0.0031 0.0069 0.1835
Toxoplasma gondii histone lysine-specific demethylase 0.0086 0.0376 1
Echinococcus multilocularis 0.0086 0.0376 0.1215
Echinococcus multilocularis uncharacterized sodium dependent transporter 0.0031 0.0069 0.0223
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.0152 0.0152
Loa Loa (eye worm) hypothetical protein 0.0031 0.0069 0.0069
Loa Loa (eye worm) hypothetical protein 0.0086 0.0376 0.0376
Brugia malayi Glycosyl hydrolases family 31 protein 0.0165 0.0815 0.0815
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0031 0.0069 0.0101
Toxoplasma gondii hypothetical protein 0.0031 0.0069 0.1835
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0019 0 0.5
Mycobacterium tuberculosis Hypothetical protein 0.0468 0.2511 0.4014
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0152 0.0493
Trichomonas vaginalis maltase-glucoamylase, putative 0.0037 0.0098 0.0391
Mycobacterium tuberculosis Conserved hypothetical protein 0.0086 0.0376 0.06
Giardia lamblia Hypothetical protein 0.0468 0.2511 1
Mycobacterium tuberculosis Possible oxidoreductase 0.0086 0.0376 0.06
Schistosoma mansoni hypothetical protein 0.0572 0.3091 0.4545
Plasmodium vivax hypothetical protein, conserved 0.0086 0.0376 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0572 0.3091 0.3091
Brugia malayi SWIRM domain containing protein 0.0086 0.0376 0.0376
Loa Loa (eye worm) hypothetical protein 0.0086 0.0376 0.0376
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0031 0.0069 0.1835
Echinococcus multilocularis lysosomal alpha glucosidase 0.0165 0.0815 0.2636
Brugia malayi amine oxidase, flavin-containing family protein 0.0086 0.0376 0.0376
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.0152 0.0493
Toxoplasma gondii Sodium:neurotransmitter symporter family protein 0.0031 0.0069 0.1835
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0098 0.0391
Loa Loa (eye worm) latrophilin receptor protein 2 0.0572 0.3091 0.3091
Schistosoma mansoni amine oxidase 0.0086 0.0376 0.0552
Mycobacterium ulcerans hypothetical protein 0.0468 0.2511 0.3727
Loa Loa (eye worm) hypothetical protein 0.0031 0.0069 0.0069
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0152 0.0493
Echinococcus multilocularis sodium:chloride dependent neurotransmitter 0.0031 0.0069 0.0223
Trypanosoma brucei glucosidase, putative 0.0037 0.0098 1
Schistosoma mansoni amine oxidase 0.0086 0.0376 0.0552
Schistosoma mansoni alpha glucosidase 0.0037 0.0098 0.0144
Loa Loa (eye worm) hypothetical protein 0.0572 0.3091 0.3091
Schistosoma mansoni sodium/chloride dependent transporter 0.0031 0.0069 0.0101
Echinococcus multilocularis Transglutaminase 0.0468 0.2511 0.8124
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.0152 0.0224
Echinococcus granulosus neutral alpha glucosidase AB 0.0037 0.0098 0.0317
Schistosoma mansoni sodium/chloride dependent transporter 0.0031 0.0069 0.0101
Loa Loa (eye worm) hypothetical protein 0.0031 0.0069 0.0069
Echinococcus granulosus lysine specific histone demethylase 1A 0.0086 0.0376 0.1215
Giardia lamblia Transglutaminase/protease, putative 0.0468 0.2511 1
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0031 0.0069 0.0101
Mycobacterium ulcerans monoamine oxidase 0.0086 0.0376 0.0558
Schistosoma mansoni sodium/chloride dependent transporter 0.0185 0.0926 0.1361
Schistosoma mansoni hypothetical protein 0.0572 0.3091 0.4545
Echinococcus multilocularis sodium and chloride dependent glycine 0.0031 0.0069 0.0223
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0086 0.0376 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0037 0.0098 1
Loa Loa (eye worm) hypothetical protein 0.0185 0.0926 0.0926
Mycobacterium ulcerans dehydrogenase 0.0086 0.0376 0.0558
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.1137 0.6256 1
Mycobacterium tuberculosis Long conserved protein 0.0468 0.2511 0.4014
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0098 0.0391
Loa Loa (eye worm) hypothetical protein 0.0031 0.0069 0.0069
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0572 0.3091 1
Trichomonas vaginalis peptide N-glycanase, putative 0.0468 0.2511 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.0069 0.0069
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0031 0.0069 0.0069
Loa Loa (eye worm) hypothetical protein 0.0185 0.0926 0.0926
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0086 0.0376 1
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0098 0.0391
Brugia malayi Glycosyl hydrolases family 31 protein 0.0037 0.0098 0.0098
Echinococcus granulosus sodium and chloride dependent glycine 0.0031 0.0069 0.0223
Echinococcus granulosus transient receptor potential cation channel 0.0159 0.0786 0.2541
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0031 0.0069 0.0069
Onchocerca volvulus 0.1242 0.684 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.1807 1 1
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.1223 0.6738 1
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0098 0.2611
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0031 0.0069 0.0101
Echinococcus granulosus lysine specific histone demethylase 1A 0.0086 0.0376 0.1215
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.1223 0.6738 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0037 0.0098 1
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0098 0.2611
Schistosoma mansoni hypothetical protein 0.0572 0.3091 0.4545
Loa Loa (eye worm) Sodium:neurotransmitter symporter family protein 0.0031 0.0069 0.0069
Loa Loa (eye worm) hypothetical protein 0.0086 0.0376 0.0376
Schistosoma mansoni hypothetical protein 0.1235 0.6802 1
Mycobacterium leprae Conserved hypothetical protein 0.0468 0.2511 1
Schistosoma mansoni norepinephrine/norepinephrine transporter 0.0185 0.0926 0.1361
Schistosoma mansoni transient receptor potential cation channel subfamily A member 0.0156 0.0768 0.1129
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0086 0.0376 1
Plasmodium falciparum protoporphyrinogen oxidase 0.0086 0.0376 1
Echinococcus granulosus Transglutaminase 0.0468 0.2511 0.8124
Brugia malayi hypothetical protein 0.0031 0.0069 0.0069
Echinococcus multilocularis lysosomal alpha glucosidase 0.0165 0.0815 0.2636
Echinococcus granulosus sodium and chloride dependent glycine 0.0031 0.0069 0.0223
Loa Loa (eye worm) solute carrier family 6 member 4 0.0185 0.0926 0.0926
Mycobacterium leprae Conserved hypothetical protein 0.0468 0.2511 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0572 0.3091 1
Leishmania major UDP-galactopyranose mutase 0.0086 0.0376 1
Loa Loa (eye worm) hypothetical protein 0.1807 1 1
Echinococcus multilocularis neutral alpha glucosidase AB 0.0037 0.0098 0.0317
Plasmodium vivax hypothetical protein, conserved 0.0086 0.0376 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.0152 0.0493
Mycobacterium ulcerans transglutaminase family protein 0.0468 0.2511 0.3727
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0031 0.0069 0.0223
Onchocerca volvulus 0.0185 0.0926 0.1266
Loa Loa (eye worm) hypothetical protein 0.0086 0.0376 0.0376
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0086 0.0376 0.0552
Schistosoma mansoni sodium/chloride dependent neurotransmitter transporter 0.0031 0.0069 0.0101
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0037 0.0098 0.0391
Loa Loa (eye worm) hypothetical protein 0.0086 0.0376 0.0376
Trypanosoma cruzi UDP-galactopyranose mutase 0.0086 0.0376 1
Trichomonas vaginalis sucrase-isomaltase, putative 0.0037 0.0098 0.0391
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0037 0.0098 0.0098
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0086 0.0376 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0468 0.2511 0.4014
Brugia malayi latrophilin 2 splice variant baaae 0.1235 0.6802 0.6802
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0098 0.0391
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0037 0.0098 0.2611
Echinococcus granulosus uncharacterized sodium dependent transporter 0.0031 0.0069 0.0223
Brugia malayi Sodium:neurotransmitter symporter family protein 1, putative 0.0031 0.0069 0.0069
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0031 0.0069 0.0101
Schistosoma mansoni alpha-glucosidase 0.0142 0.0687 0.1009
Trichomonas vaginalis alpha-glucosidase, putative 0.0037 0.0098 0.0391
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0165 0.0815 0.0815
Echinococcus granulosus ankyrin repeat protein 0.0156 0.0768 0.2484
Echinococcus multilocularis transient receptor potential cation channel 0.016 0.0787 0.2546
Echinococcus multilocularis ankyrin repeat protein 0.0156 0.0768 0.2484
Schistosoma mansoni sodium-dependent amino acid transporter 0.0031 0.0069 0.0101
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0572 0.3091 1
Loa Loa (eye worm) serotonin transporter b 0.0185 0.0926 0.0926
Brugia malayi Sodium:neurotransmitter symporter family protein 0.0031 0.0069 0.0069
Onchocerca volvulus 0.0095 0.0426 0.0528
Echinococcus multilocularis GPCR, family 2 0.0572 0.3091 1
Echinococcus granulosus serotonin transporter 0.0185 0.0926 0.2996
Loa Loa (eye worm) pigment dispersing factor receptor c 0.1807 1 1
Schistosoma mansoni sodium-dependent neurotransmitter transporter 0.0031 0.0069 0.0101
Echinococcus granulosus lysosomal alpha glucosidase 0.0165 0.0815 0.2636
Brugia malayi Latrophilin receptor protein 2 0.0572 0.3091 0.3091
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0572 0.3091 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0468 0.2511 0.4014
Echinococcus multilocularis sodium dependent neurotransmitter transporter 0.0031 0.0069 0.0223
Schistosoma mansoni alpha-glucosidase 0.0142 0.0687 0.1009
Mycobacterium ulcerans putative transglutaminase-like protein 0.0468 0.2511 0.3727

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

Bibliographic References

No literature references available for this target.

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