Detailed information for compound 1507674

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 357.958 | Formula: C20H36ClNO2
  • H donors: 1 H acceptors: 2 LogP: 6.02 Rotable bonds: 18
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCCCC(=O)/C=C/CCCCCCC(=O)NCCCl
  • InChi: 1S/C20H36ClNO2/c1-2-3-4-5-8-11-14-19(23)15-12-9-6-7-10-13-16-20(24)22-18-17-21/h12,15H,2-11,13-14,16-18H2,1H3,(H,22,24)/b15-12+
  • InChiKey: JMMBKDXLMJYNPS-NTCAYCPXSA-N  

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
Mycobacterium tuberculosis Conserved protein 0.0035 0.0317 0.0793
Loa Loa (eye worm) hypothetical protein 0.0047 0.0535 0.0535
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0317 0.0317
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Loa Loa (eye worm) oxidoreductase 0.0047 0.0535 0.0535
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Trypanosoma cruzi aldo/keto reductase, putative 0.0047 0.0535 0.0535
Loa Loa (eye worm) hypothetical protein 0.0171 0.293 0.293
Trichomonas vaginalis aldo/keto reductase, putative 0.0047 0.0535 1
Mycobacterium tuberculosis Conserved protein 0.0035 0.0317 0.0793
Loa Loa (eye worm) hypothetical protein 0.0035 0.0317 0.0317
Onchocerca volvulus 0.0047 0.0535 0.0226
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0047 0.0535 0.0535
Mycobacterium tuberculosis Probable esterase LipL 0.0035 0.0317 0.0793
Brugia malayi beta-lactamase 0.0035 0.0317 0.0317
Loa Loa (eye worm) hexokinase 0.0337 0.6137 0.6137
Entamoeba histolytica alcohol dehydrogenase, putative 0.0047 0.0535 0.0535
Echinococcus multilocularis aldo keto reductase 0.0047 0.0535 0.0535
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0047 0.0535 0.0535
Brugia malayi NADH-dependent xylose reductase 0.0047 0.0535 0.0535
Entamoeba histolytica aldose reductase, putative 0.0047 0.0535 0.0535
Loa Loa (eye worm) hypothetical protein 0.0366 0.6704 0.6704
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Leishmania major hypothetical protein, conserved 0.0035 0.0317 0.0317
Echinococcus granulosus aldo keto reductase 0.0047 0.0535 0.0535
Trichomonas vaginalis esterase, putative 0.0035 0.0317 0.5918
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0047 0.0535 0.0535
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0317 0.5918
Brugia malayi Hexokinase family protein 0.0337 0.6137 0.6137
Loa Loa (eye worm) oxidoreductase 0.0047 0.0535 0.0535
Trypanosoma cruzi aldo/keto reductase, putative 0.0047 0.0535 0.0535
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0317 0.5918
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0317 0.0317
Loa Loa (eye worm) oxidoreductase 0.0047 0.0535 0.0535
Loa Loa (eye worm) cytochrome P450 family protein 0.0049 0.0572 0.0572
Toxoplasma gondii aldose reductase, putative 0.0047 0.0535 0.0226
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0317 0.5918
Echinococcus multilocularis aldo keto reductase 0.0047 0.0535 0.0535
Brugia malayi Hexokinase family protein 0.0166 0.2842 0.2842
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0047 0.0535 1
Onchocerca volvulus 0.0047 0.0535 0.0226
Leishmania major aldo-keto reductase-like protein 0.0047 0.0535 0.0535
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Schistosoma mansoni aldo-keto reductase 0.0047 0.0535 0.0535
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0047 0.0535 1
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0035 0.0317 0.0793
Brugia malayi beta-lactamase family protein 0.0035 0.0317 0.0317
Echinococcus multilocularis voltage gated potassium channel subunit 0.0047 0.0535 0.0535
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Echinococcus granulosus hypothetical protein 0.0047 0.0535 0.0535
Toxoplasma gondii aldo-keto reductase 0.0047 0.0535 0.0226
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0047 0.0535 0.0535
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Brugia malayi beta-lactamase family protein 0.0035 0.0317 0.0317
Mycobacterium tuberculosis Conserved protein 0.0035 0.0317 0.0793
Mycobacterium ulcerans hypothetical protein 0.0047 0.0535 1
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0047 0.0535 0.0226
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0317 0.0317
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0047 0.0535 0.0535
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Mycobacterium ulcerans lipase LipD 0.0035 0.0317 0.5918
Mycobacterium ulcerans beta-lactamase 0.0035 0.0317 0.5918
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0317 0.0317
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.0047 0.0535 0.0226
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Loa Loa (eye worm) oxidoreductase 0.0047 0.0535 0.0535
Brugia malayi Cytochrome P450 family protein 0.0049 0.0572 0.0572
Schistosoma mansoni pol-related 0.0047 0.0535 0.0535
Onchocerca volvulus 0.0047 0.0535 0.0226
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Entamoeba histolytica aldose reductase, putative 0.0047 0.0535 0.0535
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Onchocerca volvulus Hexokinase homolog 0.0337 0.6137 0.6011
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0047 0.0535 0.0226
Echinococcus granulosus aldo keto reductase 0.0047 0.0535 0.0535
Trichomonas vaginalis aldo/keto reductase, putative 0.0047 0.0535 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Leishmania major prostaglandin f synthase, putative 0.0047 0.0535 0.0535
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Echinococcus multilocularis aldo keto reductase 0.0047 0.0535 0.0535
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0047 0.0535 0.0535
Loa Loa (eye worm) hypothetical protein 0.0035 0.0317 0.0317
Echinococcus granulosus aldo keto reductase 0.0047 0.0535 0.0535
Mycobacterium tuberculosis Probable lipase LipD 0.0035 0.0317 0.0793
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0047 0.0535 0.0535
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0317 0.5918
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0226 0.3995 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0317 0.0317
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Echinococcus multilocularis aldo keto reductase 0.0047 0.0535 0.0535
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Entamoeba histolytica aldose reductase, putative 0.0047 0.0535 0.0535
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0317 0.0317
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Trichomonas vaginalis aldo/keto reductase, putative 0.0047 0.0535 1
Onchocerca volvulus 0.0047 0.0535 0.0226
Loa Loa (eye worm) hypothetical protein 0.0171 0.293 0.293
Trypanosoma cruzi aldo-keto reductase 0.0047 0.0535 0.0535
Giardia lamblia Aldose reductase 0.0047 0.0535 1
Mycobacterium tuberculosis Probable hydrolase 0.0035 0.0317 0.0793
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0317 0.0317
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Echinococcus granulosus voltage gated potassium channel subunit 0.0047 0.0535 0.0535
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0047 0.0535 0.0535
Onchocerca volvulus 0.0047 0.0535 0.0226
Plasmodium vivax aldehyde reductase, putative 0.0047 0.0535 0.0226
Schistosoma mansoni potassium channel beta 0.0047 0.0535 0.0535
Loa Loa (eye worm) hypothetical protein 0.0035 0.0317 0.0317
Mycobacterium tuberculosis Probable oxidoreductase 0.0047 0.0535 0.134
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Mycobacterium tuberculosis Probable lipase LipE 0.0035 0.0317 0.0793
Loa Loa (eye worm) hexokinase 0.0166 0.2842 0.2842
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0035 0.0317 0.0793
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0317 0.5918
Trypanosoma brucei aldo-keto reductase, putative 0.0047 0.0535 0.0535
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0047 0.0535 1
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0317 0.0317
Mycobacterium leprae Possible oxidoreductase 0.0047 0.0535 1
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0047 0.0535 1
Trypanosoma brucei aldo/keto reductase, putative 0.0047 0.0535 0.0535
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0047 0.0535 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0317 0.0317
Onchocerca volvulus 0.0337 0.6137 0.6011
Mycobacterium ulcerans hypothetical protein 0.0035 0.0317 0.5918
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0317 0.5918
Brugia malayi hexokinase type II 0.0171 0.293 0.293
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0535 1
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0317 0.5918
Entamoeba histolytica alcohol dehydrogenase, putative 0.0047 0.0535 0.0535
Onchocerca volvulus 0.0047 0.0535 0.0226
Loa Loa (eye worm) beta-lactamase 0.0035 0.0317 0.0317
Giardia lamblia Aldose reductase 0.0047 0.0535 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Mycobacterium ulcerans oxidoreductase 0.0047 0.0535 1
Onchocerca volvulus 0.0047 0.0535 0.0226
Mycobacterium tuberculosis Conserved protein 0.0047 0.0535 0.134
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0317 0.0317
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0317 0.0317
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Schistosoma mansoni aldo-keto reductase 0.0047 0.0535 0.0535
Loa Loa (eye worm) oxidoreductase 0.0047 0.0535 0.0535
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0035 0.0317 0.0793
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0047 0.0535 0.0535
Trichomonas vaginalis aldo-keto reductase, putative 0.0047 0.0535 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0047 0.0535 0.0535
Trypanosoma brucei prostaglandin f synthase 0.0047 0.0535 0.0535
Loa Loa (eye worm) hypothetical protein 0.0035 0.0317 0.0317
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0047 0.0535 0.0535

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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