Detailed information for compound 1568522

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 270.326 | Formula: C16H18N2O2
  • H donors: 3 H acceptors: 2 LogP: 3.03 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Nc1ccc(c(c1)O)C(=O)NCCCc1ccccc1
  • InChi: 1S/C16H18N2O2/c17-13-8-9-14(15(19)11-13)16(20)18-10-4-7-12-5-2-1-3-6-12/h1-3,5-6,8-9,11,19H,4,7,10,17H2,(H,18,20)
  • InChiKey: KHIWTTBKSPSEFS-UHFFFAOYSA-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
Wolbachia endosymbiont of Brugia malayi enoyl-ACP reductase 0.0186 1 0.5
Plasmodium falciparum enoyl-acyl carrier reductase 0.0186 1 1
Loa Loa (eye worm) PHD-finger family protein 0.0033 0.0351 0.0418
Loa Loa (eye worm) hypothetical protein 0.0033 0.0351 0.0418
Loa Loa (eye worm) hypothetical protein 0.0074 0.291 0.3463
Entamoeba histolytica hypothetical protein 0.0041 0.084 0.5
Brugia malayi hypothetical protein 0.0132 0.6579 0.7228
Echinococcus granulosus PHD finger protein rhinoceros 0.0033 0.0351 0.0386
Loa Loa (eye worm) hypothetical protein 0.0161 0.8403 1
Schistosoma mansoni jumonji domain containing protein 0.015 0.7694 1
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0033 0.0351 0.0456
Loa Loa (eye worm) jmjC domain-containing protein 0.0068 0.2577 0.3067
Brugia malayi jmjC domain containing protein 0.0172 0.9101 1
Schistosoma mansoni hypothetical protein 0.0033 0.0351 0.0456
Brugia malayi jmjC domain containing protein 0.0103 0.4784 0.5257
Echinococcus multilocularis muscleblind protein 0.0161 0.8403 0.9233
Echinococcus multilocularis PHD finger protein rhinoceros 0.0033 0.0351 0.0386
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0028 0 0.5
Mycobacterium tuberculosis NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) 0.0186 1 0.5
Schistosoma mansoni jumonji/arid domain-containing protein 0.0103 0.4784 0.6218
Brugia malayi hypothetical protein 0.0041 0.084 0.0923
Giardia lamblia PHD finger protein 15 0.0033 0.0351 0.5
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0041 0.084 0.0923
Entamoeba histolytica hypothetical protein 0.0041 0.084 0.5
Toxoplasma gondii enoyl-acyl carrier reductase ENR 0.0186 1 1
Onchocerca volvulus Huntingtin homolog 0.0132 0.6579 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0103 0.4784 0.6218
Loa Loa (eye worm) jmjC domain-containing protein 0.0103 0.4784 0.5694
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0172 0.9101 1
Loa Loa (eye worm) hypothetical protein 0.0132 0.6579 0.7829
Loa Loa (eye worm) hypothetical protein 0.0161 0.8403 1
Mycobacterium ulcerans enoyl-(acyl carrier protein) reductase 0.0186 1 0.5
Plasmodium vivax enoyl-acyl carrier protein reductase 0.0186 1 1
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0351 0.0351
Schistosoma mansoni hypothetical protein 0.0041 0.084 0.1092
Leishmania major hypothetical protein, conserved 0.0028 0 0.5
Echinococcus multilocularis jumonji domain containing protein 0.0046 0.117 0.1285
Brugia malayi PHD-finger family protein 0.0033 0.0351 0.0386
Brugia malayi Muscleblind-like protein 0.0161 0.8403 0.9233
Plasmodium vivax hypothetical protein, conserved 0.0033 0.0351 0.0351
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0172 0.9101 1
Schistosoma mansoni transcription factor LCR-F1 0.0041 0.084 0.1092
Brugia malayi Bromodomain containing protein 0.0033 0.0351 0.0386
Echinococcus multilocularis peregrin 0.0033 0.0351 0.0386
Entamoeba histolytica hypothetical protein 0.0041 0.084 0.5
Plasmodium falciparum phd finger protein, putative 0.0033 0.0351 0.0351
Echinococcus multilocularis muscleblind protein 1 0.0161 0.8403 0.9233
Echinococcus granulosus lysine specific demethylase 5A 0.0103 0.4784 0.5257
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0028 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0132 0.6579 0.7829
Toxoplasma gondii PHD-finger domain-containing protein 0.0033 0.0351 0.0351
Echinococcus granulosus peregrin 0.0033 0.0351 0.0386
Onchocerca volvulus Huntingtin homolog 0.0132 0.6579 1
Echinococcus granulosus jumonji domain containing protein 0.0046 0.117 0.1285
Trichomonas vaginalis hypothetical protein 0.0186 1 0.5
Echinococcus multilocularis lysine specific demethylase 5A 0.0103 0.4784 0.5257
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0041 0.084 0.0923
Entamoeba histolytica hypothetical protein 0.0041 0.084 0.5
Echinococcus granulosus muscleblind protein 0.0161 0.8403 0.9233
Mycobacterium leprae NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) 0.0186 1 0.5
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0028 0 0.5

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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