Detailed information for compound 566946

Basic information

Technical information
  • TDR Targets ID: 566946
  • Name: 2-aminoethyl 2,2-diphenylpentanoate hydrochlo ride
  • MW: 333.852 | Formula: C19H24ClNO2
  • H donors: 1 H acceptors: 1 LogP: 4.52 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCC(c1ccccc1)(c1ccccc1)C(=O)OCCN.Cl
  • InChi: 1S/C19H23NO2.ClH/c1-2-13-19(18(21)22-15-14-20,16-9-5-3-6-10-16)17-11-7-4-8-12-17;/h3-12H,2,13-15,20H2,1H3;1H
  • InChiKey: BVEDXDCXECTUMT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2,2-diphenylpentanoic acid 2-aminoethyl ester hydrochloride
  • 2-azanylethyl 2,2-diphenylpentanoate hydrochloride
  • 2,2-diphenylvaleric acid 2-aminoethyl ester hydrochloride
  • aminoethyl diphenylpropylacetate
  • 51706-58-2
  • Skf 26754-A
  • 2-Aminoethyl-2,2-diphenylvalerate
  • SK&F 26754-A

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
Schistosoma mansoni hydroxyacylglutathione hydrolase (Glyoxalase II) (Glx II) 0.0034 0.0484 0.0694
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0268 1 1
Mycobacterium ulcerans lipoprotein LpqF 0.0062 0.1621 0.2936
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.1027 0.1473
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.1027 0.1473
Entamoeba histolytica DEAD/DEAH box helicase, putative 0.0128 0.4283 1
Trichomonas vaginalis glucosylceramidase, putative 0.0268 1 1
Treponema pallidum ATP-dependent RNA helicase 0.0128 0.4283 1
Trichomonas vaginalis glucosylceramidase, putative 0.0185 0.6636 0.6565
Schistosoma mansoni tar DNA-binding protein 0.0124 0.4128 0.592
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0484 0.0285
Leishmania major eukaryotic initiation factor 4a, putative 0.0128 0.4283 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0124 0.4128 0.3931
Brugia malayi MH2 domain containing protein 0.0116 0.3828 0.3769
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0781 0.0588
Loa Loa (eye worm) hypothetical protein 0.007 0.1933 0.1663
Plasmodium vivax RNA helicase-1, putative 0.0128 0.4283 1
Trichomonas vaginalis beta lactamase domain, putative 0.0034 0.0484 0.0285
Brugia malayi TAR-binding protein 0.0124 0.4128 0.4072
Schistosoma mansoni hypothetical protein 0.0194 0.6973 1
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.0128 0.4283 0.6142
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.1027 0.1473
Echinococcus multilocularis metallo beta lactamase domain containing protein 0.0034 0.0484 0.0694
Echinococcus granulosus hydroxyacylglutathione hydrolase 0.0034 0.0484 0.0694
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1027 0.1473
Echinococcus multilocularis ETHE1 protein 0.0034 0.0484 0.0694
Echinococcus granulosus eukaryotic initiation factor 4A III 0.0128 0.4283 0.6142
Echinococcus granulosus metallo beta lactamase domain containing protein 0.0034 0.0484 0.0694
Brugia malayi Bromodomain containing protein 0.0074 0.2104 0.2028
Echinococcus granulosus metallo beta lactamase domain containing protein 0.0034 0.0484 0.0694
Brugia malayi metallo-beta-lactamase superfamily protein 0.0034 0.0484 0.0393
Trichomonas vaginalis chromobox protein, putative 0.0041 0.0781 0.0588
Loa Loa (eye worm) hypothetical protein 0.0042 0.0806 0.0499
Schistosoma mansoni hypothetical protein 0.0034 0.0484 0.0694
Echinococcus multilocularis chromobox protein 1 0.0069 0.189 0.2711
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0662 0.0467
Leishmania major eukaryotic initiation factor 4a, putative 0.0128 0.4283 1
Echinococcus granulosus chromobox protein 1 0.0069 0.189 0.2711
Mycobacterium tuberculosis Class a beta-lactamase BlaC 0.0129 0.4356 1
Brugia malayi metallo-beta-lactamase superfamily protein 0.0034 0.0484 0.0393
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0059 0.149 0.2138
Trichomonas vaginalis glucosylceramidase, putative 0.0268 1 1
Echinococcus granulosus tar DNA binding protein 0.0124 0.4128 0.592
Brugia malayi ethe1-prov protein 0.0034 0.0484 0.0393
Trypanosoma brucei Eukaryotic initiation factor 4A-1 0.0128 0.4283 1
Schistosoma mansoni tar DNA-binding protein 0.0124 0.4128 0.592
Trichomonas vaginalis glucosylceramidase, putative 0.0185 0.6636 0.6565
Trichomonas vaginalis chromobox protein, putative 0.0069 0.189 0.1721
Trypanosoma brucei beta lactamase 0.0062 0.1621 0.2992
Schistosoma mansoni chromobox protein 0.0069 0.189 0.2711
Loa Loa (eye worm) TAR-binding protein 0.0124 0.4128 0.3931
Onchocerca volvulus 0.0034 0.0484 0.027
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.625 0.6172
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.108 0.0781
Loa Loa (eye worm) metallo-beta-lactamase superfamily protein 0.0034 0.0484 0.0165
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.108 0.0994
Schistosoma mansoni DEAD box ATP-dependent RNA helicase 0.0128 0.4283 0.6142
Trichomonas vaginalis glucosylceramidase, putative 0.0268 1 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.108 0.0994
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1027 0.1473
Onchocerca volvulus Putative hydrolase PNKD 0.0034 0.0484 0.027
Trichomonas vaginalis disulfide oxidoreductase, putative 0.0034 0.0484 0.0285
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.625 0.6172
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.0128 0.4283 1
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0662 0.0467
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.625 0.6172
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0537 0.077
Echinococcus multilocularis hydroxyacylglutathione hydrolase 0.0034 0.0484 0.0694
Loa Loa (eye worm) hypothetical protein 0.0034 0.0484 0.0165
Brugia malayi RNA recognition motif domain containing protein 0.0124 0.4128 0.4072
Schistosoma mansoni tar DNA-binding protein 0.0124 0.4128 0.592
Loa Loa (eye worm) MH2 domain-containing protein 0.0116 0.3828 0.3621
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0059 0.149 0.2138
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0452 0.0361
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0039 0.0662 0.0571
Onchocerca volvulus Hydroxyacylglutathione hydrolase, mitochondrial homolog 0.0034 0.0484 0.027
Trichomonas vaginalis beta lactamase domain, putative 0.0034 0.0484 0.0285
Loa Loa (eye worm) hypothetical protein 0.0039 0.0662 0.035
Brugia malayi Chain A, Human Glyoxalase Ii With Cacodylate And Acetate Ions Present In The Active Site. 0.0034 0.0484 0.0393
Schistosoma mansoni zinc phosphodiesterase 0.0034 0.0484 0.0694
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.625 0.6172
Loa Loa (eye worm) hydroxyacylglutathione hydrolase cytoplasmic 0.0034 0.0484 0.0165
Brugia malayi hypothetical protein 0.0034 0.0484 0.0393
Schistosoma mansoni bromodomain containing protein 0.0062 0.1634 0.2343
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0484 0.0285
Loa Loa (eye worm) transcription factor SMAD2 0.0116 0.3828 0.3621
Echinococcus granulosus ETHE1 protein 0.0034 0.0484 0.0694
Onchocerca volvulus Glucosylceramidase homolog 0.0176 0.625 1
Trichomonas vaginalis beta lactamase domain, putative 0.0034 0.0484 0.0285
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.1027 0.0941
Echinococcus multilocularis chromobox protein 1 0.0069 0.189 0.2711
Loa Loa (eye worm) heterochromatin protein 1 0.0069 0.189 0.1619
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.0128 0.4283 0.4163
Trichomonas vaginalis beta lactamase domain, putative 0.0034 0.0484 0.0285
Plasmodium falciparum eukaryotic initiation factor 4A 0.0128 0.4283 1
Echinococcus granulosus eukaryotic initiation factor 4A 0.0128 0.4283 0.6142
Trichomonas vaginalis chromobox protein, putative 0.0069 0.189 0.1721
Echinococcus granulosus chromobox protein 1 0.0069 0.189 0.2711
Mycobacterium tuberculosis Probable conserved lipoprotein LpqF 0.0062 0.1621 0.2936
Schistosoma mansoni tar DNA-binding protein 0.0124 0.4128 0.592
Loa Loa (eye worm) hypothetical protein 0.0049 0.108 0.0781
Echinococcus multilocularis geminin 0.0194 0.6973 1
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.625 0.6172
Loa Loa (eye worm) RNA binding protein 0.0124 0.4128 0.3931
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.1027 0.0727
Loa Loa (eye worm) hypothetical protein 0.0034 0.0484 0.0165
Trichomonas vaginalis apoptosis inducing factor, putative 0.0034 0.0484 0.0285
Echinococcus multilocularis eukaryotic initiation factor 4A III 0.0128 0.4283 0.6142
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.0781 0.0772
Toxoplasma gondii eukaryotic initiation factor-4A, putative 0.0128 0.4283 1
Loa Loa (eye worm) hypothetical protein 0.0033 0.0452 0.0133
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.1027 0.1473
Chlamydia trachomatis ribonuclease Z 0.0034 0.0484 0.5
Trypanosoma cruzi Eukaryotic initiation factor 4A-1 0.0128 0.4283 1
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0484 0.0285
Brugia malayi Bromodomain containing protein 0.0038 0.0632 0.0542
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.625 0.6172
Trichomonas vaginalis beta lactamase domain, putative 0.0034 0.0484 0.0285
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.0128 0.4283 0.4163
Schistosoma mansoni chromobox protein 0.0069 0.189 0.2711
Onchocerca volvulus 0.0034 0.0484 0.027
Trichomonas vaginalis glucosylceramidase, putative 0.0268 1 1
Trichomonas vaginalis glucosylceramidase, putative 0.0268 1 1
Brugia malayi eukaryotic initiation factor 4A 0.0128 0.4283 0.4228
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0484 0.0285
Schistosoma mansoni zinc phosphodiesterase 0.0034 0.0484 0.0694
Schistosoma mansoni hypothetical protein 0.0194 0.6973 1
Wolbachia endosymbiont of Brugia malayi metallo-beta-lactamase superfamily hydrolase 0.0034 0.0484 0.5
Echinococcus multilocularis metallo beta lactamase domain containing protein 0.0034 0.0484 0.0694
Mycobacterium leprae PROBABLE CONSERVED LIPOPROTEIN LPQF 0.0062 0.1621 1
Trichomonas vaginalis glucosylceramidase, putative 0.0268 1 1
Schistosoma mansoni hypothetical protein 0.0033 0.0452 0.0648
Brugia malayi RNA binding protein 0.0124 0.4128 0.4072
Loa Loa (eye worm) hypothetical protein 0.0034 0.0484 0.0165
Trichomonas vaginalis beta lactamase domain, putative 0.0034 0.0484 0.0285
Schistosoma mansoni hypothetical protein 0.0034 0.0484 0.0694
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0484 0.0285
Schistosoma mansoni tar DNA-binding protein 0.0124 0.4128 0.592
Loa Loa (eye worm) hydroxyacylglutathione hydrolase 0.0034 0.0484 0.0165
Trichomonas vaginalis DEAD box ATP-dependent RNA helicase, putative 0.0128 0.4283 0.4163
Brugia malayi chromobox protein homolog 3 0.0039 0.0662 0.0573
Schistosoma mansoni hypothetical protein 0.0034 0.0484 0.0694
Mycobacterium tuberculosis Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog) 0.0128 0.4283 0.9811
Loa Loa (eye worm) hypothetical protein 0.0038 0.0635 0.0321
Giardia lamblia Translation initiation factor eIF-4A, putative 0.0128 0.4283 1
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0484 0.0285
Echinococcus multilocularis zinc phosphodiesterase 0.0034 0.0484 0.0694
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0537 0.077
Mycobacterium ulcerans class a beta-lactamase, BlaC 0.0129 0.4356 1
Brugia malayi Heterochromatin protein 1 0.0069 0.189 0.1813
Trichomonas vaginalis glucosylceramidase, putative 0.0176 0.625 0.6172
Loa Loa (eye worm) hypothetical protein 0.004 0.073 0.042
Echinococcus multilocularis tar DNA binding protein 0.0124 0.4128 0.592
Loa Loa (eye worm) hypothetical protein 0.0034 0.0484 0.0165
Onchocerca volvulus Eukaryotic initiation factor 4A homolog 0.0128 0.4283 0.668
Loa Loa (eye worm) hypothetical protein 0.0128 0.4283 0.4091
Trichomonas vaginalis A-type flavoprotein 0.0034 0.0484 0.0285
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.1027 0.1473
Echinococcus granulosus zinc phosphodiesterase 0.0034 0.0484 0.0694
Echinococcus granulosus geminin 0.0194 0.6973 1
Echinococcus multilocularis eukaryotic initiation factor 4A 0.0128 0.4283 0.6142

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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