Detailed information for compound 1405320

Basic information

Technical information
  • TDR Targets ID: 1405320
  • Name: 3-furan-2-yl-1-morpholin-4-yl-3-phenylpropan- 1-one
  • MW: 285.338 | Formula: C17H19NO3
  • H donors: 0 H acceptors: 1 LogP: 1.79 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(N1CCOCC1)CC(c1ccco1)c1ccccc1
  • InChi: 1S/C17H19NO3/c19-17(18-8-11-20-12-9-18)13-15(16-7-4-10-21-16)14-5-2-1-3-6-14/h1-7,10,15H,8-9,11-13H2
  • InChiKey: GWAUUCSOPGRDKL-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 3-(2-furyl)-1-morpholino-3-phenyl-propan-1-one
  • 3-(2-furyl)-1-morpholino-3-phenylpropan-1-one
  • 3-furan-2-yl-1-morpholin-4-yl-3-phenyl-propan-1-one
  • STOCK2S-82485
  • MLS000071519
  • SMR000037958

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens hydroxyprostaglandin dehydrogenase 15-(NAD) Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum steroid dehydrogenase, putative hydroxyprostaglandin dehydrogenase 15-(NAD) 266 aa 216 aa 22.2 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Mycobacterium tuberculosis Probable oxidoreductase 0.0369 0.9928 0.5
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Trypanosoma cruzi aldo/keto reductase, putative 0.0369 0.9928 1
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0266 0.0268
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Echinococcus multilocularis aldo keto reductase 0.0369 0.9928 0.9928
Loa Loa (eye worm) oxidoreductase 0.0369 0.9928 0.9928
Mycobacterium leprae PROBABLE OXIDOREDUCTASE 0.0369 0.9928 0.5
Loa Loa (eye worm) oxidoreductase 0.0369 0.9928 0.9928
Toxoplasma gondii HEAT repeat-containing protein 0.0035 0.0266 0.0268
Leishmania major prostaglandin f2-alpha synthase/D-arabinose dehydrogenase 0.0369 0.9928 1
Mycobacterium tuberculosis Conserved protein 0.0369 0.9928 0.5
Echinococcus granulosus aldo keto reductase 0.0369 0.9928 0.9928
Echinococcus multilocularis tar DNA binding protein 0.0126 0.2899 0.2899
Leishmania major prostaglandin f synthase, putative 0.0369 0.9928 1
Entamoeba histolytica aldose reductase, putative 0.0369 0.9928 1
Brugia malayi RNA, U transporter 1 0.0099 0.2121 0.2136
Schistosoma mansoni aldo-keto reductase 0.0369 0.9928 0.9928
Entamoeba histolytica aldose reductase, putative 0.0369 0.9928 1
Brugia malayi NADH-dependent xylose reductase 0.0369 0.9928 1
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0075 0.0076
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Trichomonas vaginalis aldo/keto reductase, putative 0.0369 0.9928 1
Echinococcus granulosus tar DNA binding protein 0.0126 0.2899 0.2899
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Echinococcus granulosus importin subunit beta 1 0.0035 0.0266 0.0266
Giardia lamblia Aldose reductase 0.0369 0.9928 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0126 0.2899 0.2899
Schistosoma mansoni tar DNA-binding protein 0.0126 0.2899 0.2899
Mycobacterium ulcerans hypothetical protein 0.0369 0.9928 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0999 0.1006
Loa Loa (eye worm) hypothetical protein 0.0041 0.0449 0.0449
Trypanosoma brucei aldo-keto reductase, putative 0.0369 0.9928 1
Mycobacterium ulcerans oxidoreductase 0.0369 0.9928 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0266 0.0266
Echinococcus granulosus aldo keto reductase 0.0369 0.9928 0.9928
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0369 0.9928 1
Onchocerca volvulus 0.0369 0.9928 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0369 0.9928 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Trypanosoma cruzi aldo/keto reductase, putative 0.0369 0.9928 1
Schistosoma mansoni aldo-keto reductase 0.0369 0.9928 0.9928
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Trichomonas vaginalis alcohol dehydrogenase, putative 0.0369 0.9928 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Brugia malayi RNA recognition motif domain containing protein 0.0126 0.2899 0.292
Echinococcus multilocularis voltage gated potassium channel subunit 0.0369 0.9928 0.9928
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0028 0.0075 0.0076
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Echinococcus granulosus geminin 0.0339 0.9051 0.9051
Loa Loa (eye worm) oxidoreductase 0.0369 0.9928 0.9928
Echinococcus granulosus hypothetical protein 0.0369 0.9928 0.9928
Plasmodium vivax importin-beta 2, putative 0.0035 0.0266 0.0268
Trypanosoma brucei prostaglandin f synthase 0.0369 0.9928 1
Plasmodium vivax oxidoreductase, aldo/keto reductase domain containing protein 0.0369 0.9928 1
Loa Loa (eye worm) oxidoreductase 0.0369 0.9928 0.9928
Echinococcus granulosus voltage gated potassium channel subunit 0.0369 0.9928 0.9928
Loa Loa (eye worm) oxidoreductase 0.0369 0.9928 0.9928
Schistosoma mansoni hypothetical protein 0.0339 0.9051 0.9051
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0369 0.9928 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Trichomonas vaginalis aldo/keto reductase, putative 0.0369 0.9928 1
Toxoplasma gondii aldo-keto reductase 0.0369 0.9928 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Schistosoma mansoni tar DNA-binding protein 0.0126 0.2899 0.2899
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0369 0.9928 1
Onchocerca volvulus 0.0369 0.9928 0.5
Toxoplasma gondii aldose reductase, putative 0.0369 0.9928 1
Trypanosoma brucei aldo/keto reductase, putative 0.0369 0.9928 1
Schistosoma mansoni tar DNA-binding protein 0.0126 0.2899 0.2899
Onchocerca volvulus 0.0369 0.9928 0.5
Loa Loa (eye worm) hypothetical protein 0.006 0.0999 0.0999
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0369 0.9928 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Trichomonas vaginalis dihydrodiol dehydrogenase, putative 0.0369 0.9928 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0449 0.0452
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Plasmodium falciparum aldo-keto reductase, putative 0.0369 0.9928 1
Schistosoma mansoni potassium channel beta 0.0369 0.9928 0.9928
Schistosoma mansoni pol-related 0.0369 0.9928 0.9928
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Loa Loa (eye worm) TAR-binding protein 0.0126 0.2899 0.2899
Schistosoma mansoni importin beta-1 0.0035 0.0266 0.0266
Trypanosoma cruzi aldo-keto reductase 0.0369 0.9928 1
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Brugia malayi Importin beta-1 subunit 0.0035 0.0266 0.0268
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0369 0.9928 1
Entamoeba histolytica alcohol dehydrogenase, putative 0.0369 0.9928 1
Onchocerca volvulus 0.0369 0.9928 0.5
Schistosoma mansoni tar DNA-binding protein 0.0126 0.2899 0.2899
Echinococcus multilocularis aldo keto reductase 0.0369 0.9928 0.9928
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Trichomonas vaginalis importin beta-1, putative 0.0028 0.0075 0.0076
Leishmania major importin beta-1 subunit, putative 0.0028 0.0075 0.0076
Echinococcus multilocularis aldo keto reductase 0.0369 0.9928 0.9928
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0999 0.0999
Brugia malayi TAR-binding protein 0.0126 0.2899 0.292
Toxoplasma gondii oxidoreductase, aldo/keto reductase family protein 0.0369 0.9928 1
Leishmania major aldehyde reductase, putative,oxidoreductase, putative 0.0369 0.9928 1
Loa Loa (eye worm) glutamate-cysteine ligase modifier subunit 0.0369 0.9928 0.9928
Plasmodium falciparum importin beta, putative 0.0035 0.0266 0.0268
Toxoplasma gondii aldo/keto reductase family oxidoreductase 0.0369 0.9928 1
Giardia lamblia Aldose reductase 0.0369 0.9928 1
Trypanosoma cruzi importin beta-1 subunit, putative 0.0028 0.0075 0.0076
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Echinococcus granulosus aldo keto reductase 0.0369 0.9928 0.9928
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Schistosoma mansoni tar DNA-binding protein 0.0126 0.2899 0.2899
Loa Loa (eye worm) RNA binding protein 0.0126 0.2899 0.2899
Plasmodium vivax aldehyde reductase, putative 0.0369 0.9928 1
Leishmania major aldo-keto reductase-like protein 0.0369 0.9928 1
Brugia malayi oxidoreductase, aldo/keto reductase family protein 0.0369 0.9928 1
Brugia malayi RNA binding protein 0.0126 0.2899 0.292
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Echinococcus multilocularis aldo keto reductase 0.0369 0.9928 0.9928
Echinococcus multilocularis aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Onchocerca volvulus 0.0369 0.9928 0.5
Trypanosoma brucei importin beta-1 subunit, putative 0.0035 0.0266 0.0268
Onchocerca volvulus 0.0369 0.9928 0.5
Echinococcus multilocularis geminin 0.0339 0.9051 0.9051
Echinococcus multilocularis importin subunit beta 1 0.0035 0.0266 0.0266
Loa Loa (eye worm) hypothetical protein 0.0369 0.9928 0.9928
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0999 0.1006
Onchocerca volvulus 0.0369 0.9928 0.5
Mycobacterium leprae Possible oxidoreductase 0.0369 0.9928 0.5
Echinococcus granulosus aldo keto reductase family 1, member B4 0.0369 0.9928 0.9928
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Trichomonas vaginalis aldo/keto reductase, putative 0.0369 0.9928 1
Entamoeba histolytica aldose reductase, putative 0.0369 0.9928 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Entamoeba histolytica hypothetical protein 0.0028 0.0075 0.0076
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Entamoeba histolytica alcohol dehydrogenase, putative 0.0369 0.9928 1
Schistosoma mansoni hypothetical protein 0.0041 0.0449 0.0449
Echinococcus granulosus aldo keto reductase family 1 member B4 0.0369 0.9928 0.9928
Schistosoma mansoni hypothetical protein 0.0339 0.9051 0.9051
Leishmania major aldo/keto reductase, putative,aldo/keto reductase family-like protein 0.0369 0.9928 1
Brugia malayi glutamate-cysteine ligase modifier subunit 0.0369 0.9928 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Trichomonas vaginalis aldo-keto reductase, putative 0.0369 0.9928 1
Plasmodium falciparum aldehyde reductase, putative 0.0369 0.9928 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 15.8489 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 100 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference

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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