Detailed information for compound 347156

Basic information

Technical information
  • TDR Targets ID: 347156
  • Name: 6-(3-acetylphenyl)-2-morpholin-4-ylchromen-4- one
  • MW: 349.38 | Formula: C21H19NO4
  • H donors: 0 H acceptors: 2 LogP: 2.81 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)c1cccc(c1)c1ccc2c(c1)c(=O)cc(o2)N1CCOCC1
  • InChi: 1S/C21H19NO4/c1-14(23)15-3-2-4-16(11-15)17-5-6-20-18(12-17)19(24)13-21(26-20)22-7-9-25-10-8-22/h2-6,11-13H,7-10H2,1H3
  • InChiKey: QFHKWLWPWMPQSE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 6-(3-acetylphenyl)-2-morpholino-chromen-4-one
  • 6-(3-acetylphenyl)-2-morpholino-1-benzopyran-4-one
  • 6-(3-ethanoylphenyl)-2-morpholin-4-yl-chromen-4-one
  • 6-(3-acetylphenyl)-2-morpholino-chromone
  • 6-(3-acetylphenyl)-2-morpholino-4-chromenone

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
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 1 0.0139 0.0877 0.5
Echinococcus multilocularis protein kinase c eta type 0.0204 0.1425 0.1425
Echinococcus multilocularis serine:threonine protein kinase MRCK beta 0.0212 0.149 0.149
Echinococcus granulosus enhancer of mRNA decapping protein 4 0.0131 0.0811 0.0811
Schistosoma mansoni serine/threonine protein kinase 0.029 0.2151 0.2117
Schistosoma mansoni vav2 0.0208 0.1459 0.1423
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.004 0.0042 0.0042
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0237 0.1709 0.1709
Brugia malayi Variant SH3 domain containing protein 0.0208 0.1459 0.1451
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Loa Loa (eye worm) AGC/PKA protein kinase 0.0139 0.0877 0.0868
Schistosoma mansoni serine/threonine protein kinase 0.0212 0.149 0.1454
Loa Loa (eye worm) RhoGAP domain-containing protein 0.0208 0.1459 0.1451
Schistosoma mansoni serine/threonine protein kinase 0.0139 0.0877 0.0838
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Echinococcus multilocularis tyrosine protein kinase Fgr 0.004 0.0042 0.0042
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0036 0.0009 0.0009
Loa Loa (eye worm) AGC/AKT protein kinase 0.029 0.2151 0.2143
Schistosoma mansoni protein kinase C 0.0237 0.1709 0.1673
Brugia malayi RhoGEF domain containing protein 0.0204 0.1425 0.1417
Entamoeba histolytica diacylglycerol kinase, putative 0.0204 0.1425 0.2465
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.029 0.2151 0.2143
Echinococcus granulosus N chimaerin 0.0208 0.1459 0.1459
Loa Loa (eye worm) CAMK/PKD protein kinase 0.0212 0.149 0.1482
Echinococcus multilocularis serine:threonine protein kinase N2 0.0983 0.7997 0.7997
Echinococcus multilocularis protein kinase c epsilon type 0.122 1 1
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Brugia malayi Protein kinase domain containing protein 0.029 0.2151 0.2143
Echinococcus granulosus guanine nucleotide exchange factor VAV2 0.0208 0.1459 0.1459
Schistosoma mansoni unc-13 (munc13) 0.0237 0.1709 0.1673
Brugia malayi protein kinase C3,putative 0.0212 0.149 0.1482
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.029 0.2151 0.2151
Brugia malayi RhoGAP domain containing protein 0.0208 0.1459 0.1451
Echinococcus granulosus tyrosine protein kinase Src64B 0.004 0.0042 0.0042
Entamoeba histolytica diacylglycerol kinase, putative 0.0204 0.1425 0.2465
Echinococcus granulosus tyrosine protein kinase Src42A 0.004 0.0042 0.0042
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 3 0.0139 0.0877 0.5
Loa Loa (eye worm) Ras association domain family 1 isoform A 0.0204 0.1425 0.1417
Plasmodium vivax cAMP-dependent protein kinase catalytic subunit, putative 0.0139 0.0877 0.5
Loa Loa (eye worm) AGC/PKN protein kinase 0.029 0.2151 0.2143
Schistosoma mansoni protein kinase C mu 0.0212 0.149 0.1454
Echinococcus granulosus Protein kinase C brain isozyme 0.1187 0.9716 0.9716
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0139 0.0877 0.0877
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Entamoeba histolytica protein kinase, putative 0.029 0.2151 0.3769
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 2 0.0139 0.0877 0.5
Loa Loa (eye worm) hypothetical protein 0.0659 0.5267 0.5263
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0659 0.5267 0.5267
Schistosoma mansoni serine/threonine protein kinase 0.029 0.2151 0.2117
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Brugia malayi p70 ribosomal S6 kinase beta 0.029 0.2151 0.2143
Trichomonas vaginalis serine/threonine-protein kinase sgk, putative 0.0282 0.2085 0.9488
Loa Loa (eye worm) hypothetical protein 0.1059 0.864 0.8639
Loa Loa (eye worm) SRC-1 0.004 0.0042 0.0033
Echinococcus multilocularis raf serine:threonine protein kinase 0.0205 0.1435 0.1435
Entamoeba histolytica PH domain containing protein kinase, putative 0.0701 0.5617 1
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0204 0.1425 0.1417
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0237 0.1709 0.1709
Leishmania major protein kinase A catalytic subunit isoform 1 0.0139 0.0877 0.5
Echinococcus multilocularis tyrosine protein kinase Blk 0.0036 0.0009 0.0009
Loa Loa (eye worm) hypothetical protein 0.0973 0.7914 0.7912
Echinococcus granulosus protein kinase c eta type 0.0204 0.1425 0.1425
Echinococcus granulosus protein kinase c epsilon type 0.122 1 1
Schistosoma mansoni serine/threonine protein kinase 0.029 0.2151 0.2117
Trypanosoma cruzi cAMP-dependent protein kinase catalytic subunit 3 0.0139 0.0877 0.5
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.029 0.2151 0.2151
Loa Loa (eye worm) AGC/PKC/IOTA protein kinase 0.0212 0.149 0.1482
Brugia malayi cAMP-dependent protein kinase catalytic subunit, putative 0.0139 0.0877 0.0868
Loa Loa (eye worm) AGC/NDR protein kinase 0.029 0.2151 0.2143
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0701 0.5616 0.5612
Schistosoma mansoni serine/threonine protein kinase 0.1187 0.9716 0.9715
Onchocerca volvulus 0.0769 0.6194 1
Entamoeba histolytica PH domain containing protein kinase, putative 0.0139 0.0877 0.1479
Loa Loa (eye worm) hypothetical protein 0.0237 0.1709 0.1701
Schistosoma mansoni serine/threonine protein kinase 0.0212 0.149 0.1454
Brugia malayi SRC-1 0.004 0.0042 0.0033
Entamoeba histolytica hypothetical protein 0.0204 0.1425 0.2465
Entamoeba histolytica protein kinase, putative 0.029 0.2151 0.3769
Toxoplasma gondii AGC kinase 0.029 0.2151 1
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0139 0.0877 0.0877
Echinococcus granulosus myotubularin protein 13 0.0204 0.1425 0.1425
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0208 0.1459 0.1423
Loa Loa (eye worm) hypothetical protein 0.0863 0.6987 0.6985
Echinococcus granulosus tyrosine protein kinase Fyn 0.004 0.0042 0.0042
Echinococcus granulosus Diacylglycerol kinase theta 0.0204 0.1425 0.1425
Giardia lamblia Kinase, AGC PKA 0.0139 0.0877 0.5
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.029 0.2151 0.2151
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.004 0.0042 0.0042
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Loa Loa (eye worm) raf kinase 0.0204 0.1425 0.1417
Echinococcus granulosus serine:threonine protein kinase N2 0.0701 0.5617 0.5617
Echinococcus multilocularis intersectin 2 0.0037 0.0022 0.0022
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Schistosoma mansoni serine/threonine protein kinase 0.122 1 1
Echinococcus multilocularis Diacylglycerol kinase theta 0.0204 0.1425 0.1425
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.029 0.2151 0.2143
Loa Loa (eye worm) hypothetical protein 0.0769 0.6194 0.6191
Brugia malayi diacylglycerol kinase 0.0204 0.1425 0.1417
Brugia malayi Pleckstrin Homology Domain 0.0204 0.1425 0.1417
Echinococcus granulosus raf serine:threonine protein kinase 0.0205 0.1435 0.1435
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.029 0.2151 0.2143
Echinococcus multilocularis tyrosine protein kinase Fyn 0.004 0.0042 0.0042
Loa Loa (eye worm) RasGEF domain-containing protein 0.0204 0.1425 0.1417
Brugia malayi Ras association domain family 1 isoform A 0.0204 0.1425 0.1417
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Echinococcus granulosus serine:threonine protein kinase N2 0.029 0.2151 0.2151
Echinococcus multilocularis tyrosine protein kinase Src64B 0.004 0.0042 0.0042
Echinococcus multilocularis serine:threonine protein kinase N2 0.029 0.2151 0.2151
Brugia malayi Protein kinase domain containing protein 0.0212 0.149 0.1482
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.004 0.0042 0.0042
Schistosoma mansoni atypical protein kinase C 0.0494 0.3871 0.3844
Echinococcus multilocularis guanine nucleotide exchange factor VAV2 0.0208 0.1459 0.1459
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.004 0.0042 0.0042
Schistosoma mansoni diacylglycerol kinase theta 0.0204 0.1425 0.1389
Schistosoma mansoni hypothetical protein 0.0204 0.1425 0.1389
Toxoplasma gondii diacylglycerol kinase, putative 0.0204 0.1425 0.4305
Brugia malayi Hr1 repeat family protein 0.029 0.2151 0.2143
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.029 0.2151 0.2151
Brugia malayi Protein kinase domain containing protein 0.029 0.2151 0.2143
Echinococcus multilocularis Rac GTPase activating protein 1 0.0204 0.1425 0.1425
Echinococcus multilocularis enhancer of mRNA decapping protein 4 0.0131 0.0811 0.0811
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Schistosoma mansoni serine/threonine protein kinase 0.0139 0.0877 0.0838
Echinococcus granulosus tyrosine protein kinase Blk 0.0036 0.0009 0.0009
Brugia malayi Protein kinase domain containing protein 0.029 0.2151 0.2143
Schistosoma mansoni unc-13 (munc13) 0.0237 0.1709 0.1673
Echinococcus granulosus unc 13 munc13 0.0237 0.1709 0.1709
Schistosoma mansoni serine/threonine kinase 0.029 0.2151 0.2117
Echinococcus granulosus Rac GTPase activating protein 1 0.0204 0.1425 0.1425
Schistosoma mansoni protein kinase C mu 0.0204 0.1425 0.1389
Brugia malayi RhoGAP domain containing protein 0.0204 0.1425 0.1417
Schistosoma mansoni serine/threonine protein kinase 0.0139 0.0877 0.0838
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Echinococcus granulosus protein kinase c iota type 0.0494 0.3871 0.3871
Echinococcus multilocularis myotubularin protein 13 0.0204 0.1425 0.1425
Schistosoma mansoni serine/threonine protein kinase 0.1187 0.9716 0.9715
Loa Loa (eye worm) hypothetical protein 0.0769 0.6194 0.6191
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.029 0.2151 0.2143
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0139 0.0877 0.0877
Echinococcus multilocularis tyrosine protein kinase Srms 0.0036 0.0009 0.0009
Schistosoma mansoni diacylglycerol kinase theta 0.0204 0.1425 0.1389
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Schistosoma mansoni serine/threonine protein kinase 0.029 0.2151 0.2117
Echinococcus granulosus protein kinase C gamma type 0.0983 0.7996 0.7996
Echinococcus multilocularis unc 13 (munc13) 0.0237 0.1709 0.1709
Echinococcus multilocularis N chimaerin 0.0208 0.1459 0.1459
Echinococcus granulosus Serine/threonine-protein kinase Genghis Khan 0.0212 0.149 0.149
Entamoeba histolytica protein kinase, putative 0.029 0.2151 0.3769
Trypanosoma brucei rac serine-threonine kinase, putative 0.029 0.2151 1
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.122 1 1
Echinococcus granulosus tyrosine protein kinase Lyn 0.0048 0.0108 0.0108
Schistosoma mansoni rac gtpase activating protein 0.0204 0.1425 0.1389
Echinococcus multilocularis tyrosine protein kinase Fyn 0.004 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0139 0.0877 0.0868
Echinococcus multilocularis serine:threonine protein kinase 38 0.029 0.2151 0.2151
Loa Loa (eye worm) AGC/PKA protein kinase 0.0139 0.0877 0.0868
Trichomonas vaginalis AGC family protein kinase 0.029 0.2151 1
Echinococcus multilocularis tyrosine protein kinase Src42A 0.004 0.0042 0.0042
Loa Loa (eye worm) hypothetical protein 0.0769 0.6194 0.6191
Echinococcus multilocularis tyrosine protein kinase Fyn 0.004 0.0042 0.0042
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0139 0.0877 0.0877
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0139 0.0877 0.0877
Echinococcus granulosus tyrosine protein kinase Fyn 0.004 0.0042 0.0042
Echinococcus granulosus tyrosine protein kinase Fyn 0.004 0.0042 0.0042
Echinococcus multilocularis cAMP dependent protein kinase catalytic subunit 0.0139 0.0877 0.0877
Brugia malayi Protein kinase c protein 2 0.0904 0.7336 0.7334
Echinococcus granulosus NDR protein kinase 0.029 0.2151 0.2151
Echinococcus granulosus tyrosine kinase 0.0036 0.0009 0.0009
Entamoeba histolytica protein kinase, putative 0.029 0.2151 0.3769
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.029 0.2151 0.2151
Echinococcus multilocularis Protein kinase C, brain isozyme 0.1187 0.9716 0.9716
Brugia malayi C1-like domain containing protein 0.0212 0.149 0.1482
Brugia malayi Variant SH3 domain containing protein 0.0038 0.0022 0.0013
Brugia malayi diacylglycerol kinase 0.0204 0.1425 0.1417
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0036 0.0009 0.0009
Echinococcus multilocularis RNA directed DNA polymerase 0.0659 0.5267 0.5267
Echinococcus granulosus RNA directed DNA polymerase 0.0659 0.5267 0.5267
Entamoeba histolytica PH domain containing protein kinase, putative 0.0139 0.0877 0.1479
Echinococcus multilocularis protein kinase c iota type 0.0494 0.3871 0.3871
Echinococcus multilocularis serine threonine protein kinase 0.0983 0.7996 0.7996
Schistosoma mansoni serine/threonine protein kinase 0.0205 0.1435 0.1398
Leishmania major protein kinase A catalytic subunit isoform 2 0.0139 0.0877 0.5
Onchocerca volvulus 0.0237 0.1709 0.0594
Echinococcus granulosus intersectin 2 0.0037 0.0022 0.0022
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.004 0.0042 0.0042
Leishmania major protein kinase A catalytic subunit 0.0139 0.0877 0.5
Plasmodium falciparum cAMP-dependent protein kinase catalytic subunit 0.0139 0.0877 0.5
Loa Loa (eye worm) variant SH3 domain-containing protein 0.0038 0.0022 0.0013
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.029 0.2151 0.2151
Schistosoma mansoni chimerin-related rho-gtpase-activating protein 0.0208 0.1459 0.1423
Loa Loa (eye worm) hypothetical protein 0.0204 0.1425 0.1417
Brugia malayi Phorbol esters/diacylglycerol binding domain 0.0212 0.149 0.1482
Echinococcus granulosus cAMP dependent protein kinase catalytic subunit 0.0139 0.0877 0.0877

Activities

Activity type Activity value Assay description Source Reference
Inhibition (binding) = 46 % Inhibition against DNA-dependent protein kinase receptor at 0.5uM ChEMBL. 16302822
Inhibition (binding) = 46 % Inhibition against DNA-dependent protein kinase receptor at 0.5uM ChEMBL. 16302822

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

1 literature reference was collected for this gene.

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