Detailed information for compound 1638736

Basic information

Technical information
  • TDR Targets ID: 1638736
  • Name: 3-chloro-1-methoxypropan-1-imine
  • MW: 121.565 | Formula: C4H8ClNO
  • H donors: 0 H acceptors: 0 LogP: 0.73 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC(=N)CCCl
  • InChi: 1S/C4H8ClNO/c1-7-4(6)2-3-5/h6H,2-3H2,1H3
  • InChiKey: XZQHWPYBBMHFPE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-chloro-1-methoxy-propan-1-imine
  • (3-chloro-1-methoxy-propylidene)amine
  • NCI60_020816
  • AIDS-158026
  • AIDS158026
  • Methyl 3-chloropropanimidoate hydrochloride
  • NSC659147 (HYDROCHLORIDE SALT)

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 hypothetical protein 0.0086 0.0309 0.2656
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0035 0.0054 0.0043
Brugia malayi Trypsin family protein 0.0086 0.0309 0.2656
Echinococcus granulosus Mastin 0.0086 0.0309 0.0298
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Echinococcus granulosus endonuclease exonuclease phosphatase 0.022 0.0978 0.0968
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Loa Loa (eye worm) hypothetical protein 0.0083 0.0293 0.2672
Schistosoma mansoni transcription factor LCR-F1 0.0042 0.009 0.009
Toxoplasma gondii MAPEG family protein 0.2023 1 1
Onchocerca volvulus 0.0086 0.0309 0.2112
Entamoeba histolytica hypothetical protein 0.0042 0.009 0.5
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0086 0.0309 0.0309
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.2823
Echinococcus granulosus transmembrane protease serine 3 0.0086 0.0309 0.0298
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.2823
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0086 0.0309 0.0309
Echinococcus multilocularis histone acetyltransferase MYST2 0.0063 0.0197 0.0186
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.2823
Brugia malayi Trypsin-like protease protein 5 0.0086 0.0309 0.2656
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0086 0.0309 0.0309
Loa Loa (eye worm) hypothetical protein 0.0056 0.0158 0.1444
Echinococcus multilocularis SAM and MBT domain containing protein 0.0056 0.0158 0.0147
Trichomonas vaginalis set domain proteins, putative 0.0277 0.1264 0.5
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0042 0.0089 0.0078
Brugia malayi Trypsin family protein 0.0086 0.0309 0.2656
Echinococcus granulosus glycoprotein Antigen 5 0.0086 0.0309 0.0298
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Loa Loa (eye worm) hypothetical protein 0.0055 0.0154 0.1401
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.2823
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0086 0.0309 0.0309
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Echinococcus multilocularis glycoprotein Antigen 5 0.0086 0.0309 0.0298
Entamoeba histolytica hypothetical protein 0.0042 0.009 0.5
Schistosoma mansoni bromodomain containing protein 0.0074 0.0249 0.0249
Loa Loa (eye worm) hypothetical protein 0.0063 0.0197 0.1796
Loa Loa (eye worm) hypothetical protein 0.005 0.0129 0.1174
Echinococcus granulosus enteropeptidase 0.0086 0.0309 0.0298
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0055 0.0154 0.0143
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.2823
Loa Loa (eye worm) mbt repeat family protein 0.0056 0.0158 0.1444
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0055 0.0154 0.0154
Brugia malayi Bromodomain containing protein 0.0088 0.0318 0.2734
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0042 0.009 0.0079
Schistosoma mansoni sex comb on midleg homolog 0.0056 0.0158 0.0158
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Echinococcus multilocularis enteropeptidase 0.0086 0.0309 0.0298
Entamoeba histolytica hypothetical protein 0.0042 0.009 0.5
Plasmodium vivax SET domain protein, putative 0.0035 0.0054 0.5
Brugia malayi mbt repeat family protein 0.0056 0.0158 0.1244
Onchocerca volvulus 0.0086 0.0309 0.2112
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0035 0.0054 0.0054
Schistosoma mansoni myelin transcription factor 1 myt1 0.0063 0.0197 0.0197
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.2823
Echinococcus granulosus histone acetyltransferase MYST2 0.0063 0.0197 0.0186
Schistosoma mansoni hypothetical protein 0.0086 0.0309 0.0309
Echinococcus granulosus histone lysine methyltransferase setb 0.0055 0.0154 0.0143
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0056 0.0158 0.0158
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.0086 0.0309 0.0298
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0086 0.0309 0.0309
Schistosoma mansoni hypothetical protein 0.0339 0.1574 0.1574
Echinococcus granulosus SAM and MBT domain containing protein 0.0056 0.0158 0.0147
Loa Loa (eye worm) hypothetical protein 0.0045 0.0104 0.0946
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Echinococcus multilocularis transmembrane protease serine 3 0.0086 0.0309 0.0298
Onchocerca volvulus 0.0086 0.0309 0.2112
Schistosoma mansoni sex comb on midleg homolog 0.0056 0.0158 0.0158
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.007 0.0228 0.0217
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0063 0.0197 0.1604
Onchocerca volvulus 0.0086 0.0309 0.2112
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0042 0.009 0.0079
Schistosoma mansoni microsomal glutathione s-transferase 0.2023 1 1
Echinococcus multilocularis Mastin 0.0086 0.0309 0.0298
Schistosoma mansoni hypothetical protein 0.0086 0.0309 0.0309
Onchocerca volvulus 0.0056 0.0158 0.0862
Echinococcus multilocularis microsomal glutathione S transferase 3 0.2023 1 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Brugia malayi Trypsin family protein 0.0086 0.0309 0.2656
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0243 0.1096 1
Schistosoma mansoni membrane associated proteins in eicosanoid and glutathione metabolism family member 0.2023 1 1
Loa Loa (eye worm) MBCTL1 0.0063 0.0197 0.1796
Brugia malayi Pre-SET motif family protein 0.0035 0.0054 0.027
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0086 0.0309 0.0309
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0035 0.0054 0.0054
Brugia malayi Pre-SET motif family protein 0.0243 0.1096 1
Loa Loa (eye worm) hypothetical protein 0.0086 0.0309 0.2823
Schistosoma mansoni hypothetical protein 0.0042 0.009 0.009
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0026 0.0011 0.0011
Onchocerca volvulus 0.0086 0.0309 0.2112
Mycobacterium ulcerans hypothetical protein 0.0086 0.0309 0.5
Entamoeba histolytica hypothetical protein 0.0042 0.009 0.5
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0086 0.0309 0.0309
Brugia malayi Bromodomain containing protein 0.0045 0.0103 0.0731
Onchocerca volvulus 0.0277 0.1264 1
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.0086 0.0309 0.0298
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0086 0.0309 0.0309
Loa Loa (eye worm) hypothetical protein 0.0048 0.0117 0.1072
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0055 0.0154 0.0154
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0042 0.0089 0.0078
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.0086 0.0309 0.0298
Echinococcus multilocularis polycomb protein SCMH1 0.0056 0.0158 0.0147
Brugia malayi Trypsin family protein 0.0086 0.0309 0.2656
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.007 0.0228 0.0217
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0034 0.0047 0.0036
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.0086 0.0309 0.2656
Loa Loa (eye worm) trypsin family protein 0.0086 0.0309 0.2823
Echinococcus granulosus polycomb protein SCMH1 0.0056 0.0158 0.0147
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0063 0.0197 0.0186
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.0086 0.0309 0.0298
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0063 0.0197 0.0186
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309
Onchocerca volvulus 0.0086 0.0309 0.2112
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.022 0.0978 0.0968
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0056 0.0158 0.0862
Brugia malayi mbt repeat family protein 0.0056 0.0158 0.1244
Brugia malayi hypothetical protein 0.0042 0.009 0.0604
Schistosoma mansoni cercarial elastase (S01 family) 0.0086 0.0309 0.0309

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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