Detailed information for compound 819009

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 330.464 | Formula: C20H30N2O2
  • H donors: 1 H acceptors: 1 LogP: 2.58 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)NCC1CCC2(O1)CCN(CC2)Cc1cc(C)cc(c1)C
  • InChi: 1S/C20H30N2O2/c1-15-10-16(2)12-18(11-15)14-22-8-6-20(7-9-22)5-4-19(24-20)13-21-17(3)23/h10-12,19H,4-9,13-14H2,1-3H3,(H,21,23)
  • InChiKey: IWHPLDVQWMVVKQ-UHFFFAOYSA-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
Toxoplasma gondii methionine aminopeptidase, type i, putative 0.0288 0.2872 0.9383
Schistosoma mansoni methionyl aminopeptidase 1 (M24 family) 0.0288 0.2872 1
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0259 0.2533 0.2533
Mycobacterium tuberculosis Methionine aminopeptidase MapB (map) (peptidase M) 0.0288 0.2872 1
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Echinococcus multilocularis methionyl aminopeptidase 1 (M24 family) 0.0305 0.3061 1
Trypanosoma cruzi metallo- peptidase, Clan MG, Family M24 0.0305 0.3061 1
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0126 0.102 0.3331
Entamoeba histolytica methionine aminopeptidase, putative 0.0036 0 0.5
Plasmodium falciparum methionine aminopeptidase 1a, putative 0.0288 0.2872 0.9383
Loa Loa (eye worm) methionine aminopeptidase type I 0.0305 0.3061 1
Onchocerca volvulus Methionine aminopeptidase 2 homolog 0.0036 0 0.5
Mycobacterium tuberculosis Methionine aminopeptidase MapA (map) (peptidase M) (MetAP) 0.0288 0.2872 1
Toxoplasma gondii methionine aminopeptidase 0.0288 0.2872 0.9383
Mycobacterium leprae PROBABLE METHIONINE AMINOPEPTIDASE MAPB (MAP) (PEPTIDASE M) 0.0288 0.2872 1
Loa Loa (eye worm) hypothetical protein 0.0248 0.2411 0.7877
Mycobacterium ulcerans methionine aminopeptidase 0.0288 0.2872 1
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Giardia lamblia Xaa-Pro dipeptidase 0.0036 0 0.5
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Onchocerca volvulus 0.0036 0 0.5
Schistosoma mansoni hypothetical protein 0.0126 0.102 0.355
Chlamydia trachomatis methionine aminopeptidase 0.0288 0.2872 1
Treponema pallidum methionine aminopeptidase (map) 0.0288 0.2872 1
Leishmania major methionine aminopeptidase, putative,metallo-peptidase, Clan MG, Family M24 0.0305 0.3061 1
Onchocerca volvulus Dipeptidase C homolog 0.0036 0 0.5
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0126 0.102 0.3331
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Giardia lamblia Xaa-Pro dipeptidase 0.0036 0 0.5
Echinococcus granulosus methionyl aminopeptidase 1 M24 family 0.0305 0.3061 1
Toxoplasma gondii methionine aminopeptidase 0.0305 0.3061 1
Plasmodium falciparum methionine aminopeptidase 1b, putative 0.0305 0.3061 1
Schistosoma mansoni methionyl aminopeptidase 1 (M24 family) 0.0288 0.2872 1
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0249 0.2424 0.792
Entamoeba histolytica Xaa-Pro dipeptidase, putative 0.0036 0 0.5
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Schistosoma mansoni thyroid hormone receptor 0.0146 0.125 0.4352
Entamoeba histolytica peptidase, putative 0.0036 0 0.5
Plasmodium vivax methionine aminopeptidase 1b, putative 0.0305 0.3061 1
Plasmodium vivax methionine aminopeptidase 1a, putative 0.0288 0.2872 0.9383
Giardia lamblia Methionine aminopeptidase 0.0036 0 0.5
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Brugia malayi Methionine aminopeptidase protein type I 0.0305 0.3061 0.3061
Wolbachia endosymbiont of Brugia malayi methionine aminopeptidase 0.0288 0.2872 1
Trypanosoma brucei methionine aminopeptidase, putative 0.0305 0.3061 1
Entamoeba histolytica aminopeptidase, putative 0.0036 0 0.5
Echinococcus multilocularis methionyl aminopeptidase 1 (M24 family) 0.0288 0.2872 0.9383
Onchocerca volvulus FACT complex subunit SPT16 homolog 0.0036 0 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0249 0.2424 0.2424
Trypanosoma brucei metallo- peptidase, Clan MG, Family M24 0.0305 0.3061 1
Schistosoma mansoni thyroid hormone receptor 0.0146 0.125 0.4352
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Entamoeba histolytica hypothetical protein, conserved 0.0036 0 0.5
Echinococcus multilocularis thyroid hormone receptor alpha 0.0146 0.125 0.4084
Brugia malayi Nuclear hormone receptor-like 1 0.0249 0.2424 0.2424
Mycobacterium leprae PROBABLE METHIONINE AMINOPEPTIDASE MAPA (MAP) (PEPTIDASE M) (MetAP) 0.0288 0.2872 1
Mycobacterium ulcerans methionine aminopeptidase MapB 0.0288 0.2872 1
Trypanosoma brucei methionine aminopeptidase, type I, putative 0.0305 0.3061 1
Trichomonas vaginalis Clan MG, familly M24, aminopeptidase P-like metallopeptidase 0.0036 0 0.5
Trypanosoma cruzi metallo- peptidase, Clan MG, Family M24 0.0305 0.3061 1

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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