Detailed information for compound 769816

Basic information

Technical information
  • TDR Targets ID: 769816
  • Name: 4-(furan-2-carbonyl)-3-hydroxy-5-(4-methylphe nyl)-1-(3-morpholin-4-ylpropyl)-5H-pyrrol-2-o ne
  • MW: 410.463 | Formula: C23H26N2O5
  • H donors: 1 H acceptors: 3 LogP: 2.77 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)C1N(CCCN2CCOCC2)C(=O)C(=C1C(=O)c1ccco1)O
  • InChi: 1S/C23H26N2O5/c1-16-5-7-17(8-6-16)20-19(21(26)18-4-2-13-30-18)22(27)23(28)25(20)10-3-9-24-11-14-29-15-12-24/h2,4-8,13,20,27H,3,9-12,14-15H2,1H3
  • InChiKey: CPUPSYMGCMXZFI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-(furan-2-carbonyl)-3-hydroxy-5-(4-methylphenyl)-1-(3-morpholinopropyl)-5H-pyrrol-2-one
  • 4-(2-furyl-oxomethyl)-3-hydroxy-5-(4-methylphenyl)-1-(3-morpholinopropyl)-5H-pyrrol-2-one
  • 4-(furan-2-carbonyl)-3-hydroxy-5-(4-methylphenyl)-1-(3-morpholinopropyl)-3-pyrrolin-2-one
  • 4-furan-2-ylcarbonyl-3-hydroxy-5-(4-methylphenyl)-1-(3-morpholin-4-ylpropyl)-5H-pyrrol-2-one
  • BAS 03302501
  • UNM000003548901
  • STOCK2S-45850

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
Echinococcus multilocularis snurportin 1 0.0317 0.8449 0.913
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0165 0.4101 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0095 0.2101 0.2486
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.0064 0.1275
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0039 0.0499 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0095 0.2101 0.2101
Loa Loa (eye worm) transcription factor SMAD2 0.0371 1 1
Brugia malayi RNA, U transporter 1 0.0084 0.1792 0.1792
Brugia malayi hypothetical protein 0.0037 0.0432 0.0432
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0165 0.4101 1
Echinococcus granulosus smad 0.0025 0.0098 0.0106
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0057 0.1003 0.2445
Trichomonas vaginalis importin beta-1, putative 0.0024 0.0064 0.1275
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0108 0.2473 0.4744
Schistosoma mansoni smad1 5 8 and 0.0025 0.0098 0.0116
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0039 0.0499 0.1218
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.004 0.0524 0.0566
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0165 0.4101 0.5
Schistosoma mansoni thyroid hormone receptor 0.0139 0.3351 0.3966
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0165 0.4101 1
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0108 0.2473 1
Brugia malayi Importin beta-1 subunit 0.003 0.0224 0.0224
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0095 0.2101 0.2101
Loa Loa (eye worm) PHD-finger family protein 0.0023 0.0035 0.0035
Echinococcus granulosus mothers against decapentaplegic 5 0.0025 0.0098 0.0106
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0165 0.4101 0.5
Schistosoma mansoni zinc finger protein 0.0022 0.0001 0.0001
Brugia malayi PHD-finger family protein 0.0028 0.0171 0.0171
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0039 0.0499 0.1218
Schistosoma mansoni peptidase Clp (S14 family) 0.0165 0.4101 0.4854
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0432 0.0512
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0165 0.4101 0.4432
Loa Loa (eye worm) hypothetical protein 0.0051 0.084 0.084
Loa Loa (eye worm) hypothetical protein 0.0079 0.1637 0.1637
Brugia malayi RNA recognition motif domain containing protein 0.0138 0.3326 0.3326
Loa Loa (eye worm) hypothetical protein 0.0051 0.082 0.082
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0039 0.0499 0.054
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0057 0.1003 0.1398
Schistosoma mansoni hypothetical protein 0.0129 0.3055 0.3616
Loa Loa (eye worm) hypothetical protein 0.0046 0.0678 0.0678
Brugia malayi exodeoxyribonuclease III family protein 0.0039 0.0499 0.0499
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0432 0.0467
Echinococcus granulosus peptidase Clp S14 family 0.0108 0.2473 0.2672
Toxoplasma gondii hypothetical protein 0.0057 0.1003 0.2445
Echinococcus granulosus tumor protein p63 0.0345 0.9254 1
Echinococcus multilocularis peptidase Clp (S14 family) 0.0108 0.2473 0.2672
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0165 0.4101 1
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0039 0.0499 0.0499
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0095 0.2101 0.227
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0317 0.8449 0.8449
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0039 0.0499 1
Schistosoma mansoni tar DNA-binding protein 0.0138 0.3326 0.3936
Echinococcus granulosus zinc finger protein 0.0022 0.0001 0.0001
Schistosoma mansoni hypothetical protein 0.0023 0.0035 0.0041
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0025 0.0096 0.0103
Schistosoma mansoni smad 0.0025 0.0098 0.0116
Schistosoma mansoni smad1 5 8 and 0.0025 0.0098 0.0116
Loa Loa (eye worm) MH2 domain-containing protein 0.0025 0.0098 0.0098
Schistosoma mansoni hypothetical protein 0.0037 0.0432 0.0512
Brugia malayi Bromodomain containing protein 0.0043 0.06 0.06
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0025 0.0096 0.0113
Entamoeba histolytica hypothetical protein 0.0037 0.0432 0.8653
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0067 0.1285 0.1388
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0039 0.0499 1
Schistosoma mansoni importin beta-1 0.003 0.0224 0.0266
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0039 0.0499 1
Echinococcus granulosus tar DNA binding protein 0.0138 0.3326 0.3594
Echinococcus multilocularis tar DNA binding protein 0.0138 0.3326 0.3594
Echinococcus multilocularis smad 0.0025 0.0098 0.0106
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0025 0.0098 0.0116
Loa Loa (eye worm) hypothetical protein 0.0043 0.0602 0.0602
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0095 0.2101 0.227
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0095 0.2101 0.227
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0064 0.1275
Entamoeba histolytica hypothetical protein 0.0037 0.0432 0.8653
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0039 0.0499 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.0739 0.0739
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0432 0.0467
Brugia malayi Probable ClpP-like protease 0.0165 0.4101 0.4101
Schistosoma mansoni tar DNA-binding protein 0.0138 0.3326 0.3936
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0165 0.4101 1
Schistosoma mansoni thyroid hormone receptor 0.0139 0.3351 0.3966
Echinococcus granulosus fetal alzheimer antigen falz 0.0025 0.0096 0.0103
Echinococcus granulosus snurportin 1 0.0317 0.8449 0.913
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.084 0.084
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0039 0.0499 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0095 0.2101 0.2486
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0095 0.2101 0.227
Entamoeba histolytica hypothetical protein 0.0024 0.0064 0.1275
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0165 0.4101 0.4432
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0039 0.0499 0.054
Loa Loa (eye worm) hypothetical protein 0.003 0.0224 0.0224
Toxoplasma gondii exonuclease III APE 0.0039 0.0499 0.1218
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0138 0.3326 0.3326
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0024 0.0064 0.1275
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.004 0.0524 0.0566
Loa Loa (eye worm) TAR-binding protein 0.0138 0.3326 0.3326
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0129 0.3055 0.3302
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0165 0.4101 1
Brugia malayi MH1 domain containing protein 0.0025 0.0098 0.0098
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0165 0.4101 1
Schistosoma mansoni tar DNA-binding protein 0.0138 0.3326 0.3936
Schistosoma mansoni hypothetical protein 0.0317 0.8449 1
Schistosoma mansoni hypothetical protein 0.0035 0.0376 0.0445
Schistosoma mansoni tar DNA-binding protein 0.0138 0.3326 0.3936
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0025 0.0098 0.0106
Loa Loa (eye worm) MH1 domain-containing protein 0.0025 0.0098 0.0098
Loa Loa (eye worm) Smad1 0.0025 0.0098 0.0098
Brugia malayi Smad1 0.0025 0.0098 0.0098
Echinococcus multilocularis mothers against decapentaplegic 5 0.0025 0.0098 0.0106
Brugia malayi Bromodomain containing protein 0.0084 0.1774 0.1774
Schistosoma mansoni ap endonuclease 0.0039 0.0499 0.0591
Trichomonas vaginalis ap endonuclease, putative 0.0039 0.0499 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0067 0.1285 0.1388
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0165 0.4101 1
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0129 0.3055 0.3302
Schistosoma mansoni cellular tumor antigen P53 0.0051 0.082 0.0971
Echinococcus multilocularis zinc finger protein 0.0022 0.0001 0.0001
Echinococcus multilocularis tumor protein p63 0.0345 0.9254 1
Brugia malayi MH2 domain containing protein 0.0025 0.0098 0.0098
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.084 0.084
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0095 0.2101 0.2486
Schistosoma mansoni ap endonuclease 0.0039 0.0499 0.0591
Entamoeba histolytica hypothetical protein 0.0037 0.0432 0.8653
Entamoeba histolytica hypothetical protein 0.0037 0.0432 0.8653
Echinococcus multilocularis thyroid hormone receptor alpha 0.0139 0.3351 0.3621
Trichomonas vaginalis ap endonuclease, putative 0.0039 0.0499 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.084 0.084
Loa Loa (eye worm) RNA binding protein 0.0138 0.3326 0.3326
Toxoplasma gondii HEAT repeat-containing protein 0.003 0.0224 0.0547
Leishmania major importin beta-1 subunit, putative 0.0024 0.0064 0.1275
Plasmodium vivax importin-beta 2, putative 0.003 0.0224 0.0547
Echinococcus multilocularis importin subunit beta 1 0.003 0.0224 0.0243
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0057 0.1003 0.2445
Onchocerca volvulus 0.0051 0.082 0.5
Schistosoma mansoni bromodomain containing protein 0.0071 0.1399 0.1656
Schistosoma mansoni Smad4 0.0025 0.0098 0.0116
Echinococcus granulosus TGF beta signal transducer SmadC 0.0025 0.0098 0.0106
Schistosoma mansoni smad1 5 8 and 0.0025 0.0098 0.0116
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0165 0.4101 1
Loa Loa (eye worm) hypothetical protein 0.0035 0.0376 0.0376
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0224 0.4493
Brugia malayi RNA binding protein 0.0138 0.3326 0.3326
Brugia malayi TAR-binding protein 0.0138 0.3326 0.3326
Brugia malayi MH1 domain containing protein 0.0025 0.0098 0.0098
Echinococcus granulosus Smad4 0.0025 0.0098 0.0106
Trypanosoma brucei importin beta-1 subunit, putative 0.003 0.0224 0.4493
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0108 0.2473 1
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.0376 0.0376
Plasmodium falciparum importin beta, putative 0.003 0.0224 0.0547
Brugia malayi MH2 domain containing protein 0.0025 0.0098 0.0098
Loa Loa (eye worm) hypothetical protein 0.0165 0.4101 0.4101
Schistosoma mansoni tar DNA-binding protein 0.0138 0.3326 0.3936
Echinococcus multilocularis Smad4 0.0025 0.0098 0.0106
Echinococcus granulosus importin subunit beta 1 0.003 0.0224 0.0243
Loa Loa (eye worm) MH2 domain-containing protein 0.0371 1 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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