Detailed information for compound 1709110

Basic information

Technical information
  • TDR Targets ID: 1709110
  • Name: N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopr opanecarboxamide
  • MW: 230.262 | Formula: C13H14N2O2
  • H donors: 2 H acceptors: 2 LogP: 0.7 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1CCc2c(N1)cc(cc2)NC(=O)C1CC1
  • InChi: 1S/C13H14N2O2/c16-12-6-4-8-3-5-10(7-11(8)15-12)14-13(17)9-1-2-9/h3,5,7,9H,1-2,4,6H2,(H,14,17)(H,15,16)
  • InChiKey: YYQWWRQHWDKWGS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2-keto-3,4-dihydro-1H-quinolin-7-yl)cyclopropanecarboxamide
  • A3576/0151805
  • Cyclopropanecarboxylic acid (2-oxo-1,2,3,4-tetrahydro-quinolin-7-yl)-amide
  • ZINC01425337
  • MLS000719136
  • BAS 14051139
  • SMR000291404

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
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
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.1385 0.5
Toxoplasma gondii t-complex protein beta subunit 0.0024 0.1522 0.4674
Echinococcus granulosus intermediate filament protein 0.0026 0.1952 0.0658
Echinococcus multilocularis tar DNA binding protein 0.0076 1 1
Loa Loa (eye worm) intermediate filament protein 0.0026 0.1952 0.1952
Echinococcus multilocularis lamin 0.0026 0.1952 0.0658
Loa Loa (eye worm) TAR-binding protein 0.0076 1 1
Trypanosoma brucei T-complex protein 1, beta subunit, putative 0.0024 0.1522 0.4674
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Brugia malayi T-complex protein 1, beta subunit 0.0024 0.1522 0.1522
Echinococcus granulosus chaperonin containing TCP1 subunit 2 beta 0.0024 0.1522 0.0159
Echinococcus granulosus lamin dm0 0.0026 0.1952 0.0658
Leishmania major T-complex protein 1, beta subunit, putative 0.0024 0.1522 0.4674
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.1678 1
Onchocerca volvulus 0.0026 0.1952 0.5
Onchocerca volvulus 0.0026 0.1952 0.5
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.1385 0.1385
Echinococcus multilocularis lamin dm0 0.0026 0.1952 0.0658
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.1385 0.5
Schistosoma mansoni lamin 0.0026 0.1952 0.0658
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0024 0.1522 0.0159
Brugia malayi TAR-binding protein 0.0076 1 1
Echinococcus multilocularis musashi 0.0026 0.1952 0.0658
Trypanosoma brucei PAB1-binding protein , putative 0.0025 0.1678 1
Trichomonas vaginalis chaperonin-60kD, ch60, putative 0.0024 0.1522 1
Loa Loa (eye worm) RNA binding protein 0.0076 1 1
Brugia malayi T-complex protein 1, beta subunit 0.0024 0.1522 0.1522
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.1385 0.5
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0024 0.1522 0.0159
Schistosoma mansoni lamin 0.0026 0.1952 0.0658
Plasmodium vivax T-complex protein 1 subunit beta, putative 0.0024 0.1522 0.4674
Loa Loa (eye worm) T-complex protein 1 0.0024 0.1522 0.1522
Echinococcus granulosus lamin 0.0026 0.1952 0.0658
Brugia malayi intermediate filament protein 0.0026 0.1952 0.1952
Brugia malayi hypothetical protein 0.0025 0.1678 0.1678
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.1678 1
Entamoeba histolytica T-complex protein 1 beta subunit, putative 0.0024 0.1522 1
Brugia malayi hypothetical protein 0.0016 0.0285 0.0285
Plasmodium falciparum ataxin-2 like protein, putative 0.0025 0.1678 1
Plasmodium vivax ataxin-2 like protein, putative 0.0025 0.1678 1
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.1385 0.1385
Echinococcus granulosus tar DNA binding protein 0.0076 1 1
Brugia malayi RNA recognition motif domain containing protein 0.0076 1 1
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.1875 0.1875
Leishmania major hypothetical protein, conserved 0.0025 0.1678 1
Echinococcus multilocularis chaperonin containing TCP1, subunit 2 (beta) 0.0024 0.1522 0.0159
Giardia lamblia TCP-1 chaperonin subunit beta 0.0024 0.1522 1
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0024 0.1522 0.0159
Plasmodium falciparum T-complex protein 1 subunit beta 0.0024 0.1522 0.4674
Brugia malayi Intermediate filament tail domain containing protein 0.0026 0.1952 0.1952
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 1 1
Toxoplasma gondii LsmAD domain-containing protein 0.0025 0.1678 1
Loa Loa (eye worm) hypothetical protein 0.0026 0.1952 0.1952
Loa Loa (eye worm) hypothetical protein 0.0025 0.1678 0.1678
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0025 0.1678 1
Trichomonas vaginalis chaperonin, putative 0.0024 0.1522 1
Schistosoma mansoni intermediate filament proteins 0.0026 0.1952 0.0658
Schistosoma mansoni tar DNA-binding protein 0.0076 1 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0026 0.1952 0.1952
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.1385 0.5
Trypanosoma cruzi T-complex protein 1, beta subunit, putative 0.0024 0.1522 0.4674

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0004 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.5481 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PubChem BioAssay. qHTS for Small Molecule Inhibitors of the ERG Ets/DNA interaction. (Class of assay: confirmatory) 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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