Detailed information for compound 2255891

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 221.158 | Formula: C14H20FN
  • H donors: 0 H acceptors: 0 LogP: 3.43 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 0
  • SMILES: CCN1CCC(CC1)Cc1ccc(cc1)F
  • InChi: InChI=1S/C14H20FN/c1-2-16-9-7-13(8-10-16)11-12-3-5-14(15)6-4-12/h3-6,13H,2,7-11H2,1H3
  • InChiKey: UQVNHCBACIGBGA-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

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
Trichomonas vaginalis m-phase inducer phosphatase, putative 0.0064 0.0586 0.0667
Brugia malayi E1-E2 ATPase family protein 0.0028 0.0117 0.0242
Plasmodium falciparum non-SERCA-type Ca2+ -transporting P-ATPase 0.0047 0.0363 1
Trichomonas vaginalis cation-transporting ATPase, putative 0.0023 0.0062 0.0021
Schistosoma mansoni ATPase 0.0043 0.0308 0.0308
Onchocerca volvulus 0.0119 0.1282 0.409
Echinococcus multilocularis geminin 0.0198 0.2279 0.2279
Echinococcus multilocularis sodium:potassium transporting ATPase subunit 0.0242 0.2847 0.2847
Trypanosoma cruzi calcium-translocating P-type ATPase, putative 0.0023 0.0062 0.1409
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0022 0.0045 0.0045
Toxoplasma gondii P-type ATPase PMA1 0.0023 0.0062 0.0529
Echinococcus multilocularis nervana 2 0.02 0.2314 0.2314
Loa Loa (eye worm) sodium/potassium-transporting ATPase subunit alpha 0.0106 0.112 0.2313
Loa Loa (eye worm) hypothetical protein 0.0028 0.0129 0.0265
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0032 0.0167 0.0167
Echinococcus granulosus intermediate filament protein 0.0028 0.0129 0.0129
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0399 0.4843 1
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0022 0.0045 0.0045
Echinococcus granulosus plasma membrane calcium transporting ATPase 2 0.0047 0.0363 0.0363
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0043 0.0308 0.8425
Loa Loa (eye worm) calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.003 0.0146 0.0302
Plasmodium falciparum calcium-transporting ATPase 0.0047 0.0363 1
Brugia malayi Rhodanese-like domain containing protein 0.0064 0.0586 0.121
Leishmania major calcium-transporting ATPase, putative 0.0047 0.0363 1
Echinococcus multilocularis sarco:endoplasmic reticulum calcium ATPase 0.0043 0.0308 0.0308
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0047 0.0363 0.0363
Trypanosoma cruzi calcium-transporting ATPase, putative 0.003 0.0146 0.3812
Echinococcus granulosus nervana 2 0.02 0.2314 0.2314
Loa Loa (eye worm) hypothetical protein 0.0064 0.0586 0.121
Onchocerca volvulus 0.0242 0.2847 0.9635
Brugia malayi Probable calcium-transporting ATPase KIAA0703 0.003 0.0146 0.0302
Trichomonas vaginalis mitotic inducer phosphatase CDC25, putative 0.0064 0.0586 0.0667
Echinococcus multilocularis Na+:K+ ATPase alpha subunit 0.0124 0.1338 0.1338
Toxoplasma gondii E1-E2 ATPase subfamily protein 0.0023 0.0062 0.0529
Brugia malayi intermediate filament protein 0.0028 0.0129 0.0265
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0032 0.0167 0.0167
Echinococcus granulosus nervana 2 0.0242 0.2847 0.2847
Trypanosoma brucei calcium-transporting ATPase, putative 0.003 0.0146 0.3178
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0043 0.0308 0.2035
Schistosoma mansoni m-phase inducer phosphatase(cdc25) 0.0064 0.0586 0.0586
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.0399 0.4843 0.4843
Schistosoma mansoni ATPase 0.0043 0.0308 0.0308
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0022 0.0045 0.0929
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0043 0.0308 0.0324
Schistosoma mansoni ap endonuclease 0.0022 0.0045 0.0045
Mycobacterium ulcerans cation-transporter ATPase I CtpI 0.0026 0.0091 0.0371
Trichomonas vaginalis cdc25b, putative 0.0064 0.0586 0.0667
Onchocerca volvulus 0.0064 0.0586 0.1622
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0028 0.0129 0.0265
Brugia malayi Rhodanese-like domain containing protein 0.0064 0.0586 0.121
Entamoeba histolytica rodhanase-like domain containing protein 0.0064 0.0586 0.0704
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0022 0.0045 0.004
Onchocerca volvulus 0.0064 0.0586 0.1622
Echinococcus multilocularis calcium transporting atpase 0.0047 0.0363 0.0363
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0242 0.2847 0.2847
Echinococcus granulosus Ca2 transporting ATPase plasma membrane 0.0047 0.0363 0.0363
Brugia malayi Pre-SET motif family protein 0.022 0.2563 0.5292
Trichomonas vaginalis m-phase inducer phosphatase, putative 0.0064 0.0586 0.0667
Trichomonas vaginalis cation-transporting ATPase, putative 0.0043 0.0308 0.0324
Echinococcus multilocularis Ca2+ transporting ATPase plasma membrane 0.0047 0.0363 0.0363
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0047 0.0363 1
Loa Loa (eye worm) Na,K-ATPase alpha subunit 0.0124 0.1338 0.2762
Schistosoma mansoni sodium / potassium ATPase beta chain 0.02 0.2314 0.2314
Loa Loa (eye worm) E1-E2 ATPase 0.0023 0.0062 0.0128
Echinococcus multilocularis nervana 2 0.02 0.2314 0.2314
Loa Loa (eye worm) hypothetical protein 0.0064 0.0586 0.121
Trypanosoma cruzi P-type H+-ATPase, putative 0.0023 0.0062 0.1409
Trypanosoma cruzi Calcium ATPase SERCA-like 0.0043 0.0308 0.8425
Schistosoma mansoni ap endonuclease 0.0022 0.0045 0.0045
Schistosoma mansoni hypothetical protein 0.0198 0.2279 0.2279
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0047 0.0363 0.0392
Brugia malayi Pre-SET motif family protein 0.0032 0.0167 0.0345
Trypanosoma cruzi plasma-membrane proton-efflux P-type ATPase, putative 0.0023 0.0062 0.1409
Onchocerca volvulus 0.02 0.2314 0.7748
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0043 0.0308 0.0363
Schistosoma mansoni microtubule-associated protein tau 0.0805 1 1
Schistosoma mansoni intermediate filament proteins 0.0028 0.0129 0.0129
Treponema pallidum exodeoxyribonuclease (exoA) 0.0022 0.0045 0.5
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.022 0.2563 0.5292
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.02 0.2314 0.2314
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0047 0.0363 0.0392
Trypanosoma brucei vacuolar-type Ca2+-ATPase 1 0.0043 0.0308 0.8264
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0058 0.0505 0.1043
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0242 0.2847 0.2847
Trichomonas vaginalis set domain proteins, putative 0.025 0.295 0.3577
Entamoeba histolytica dual specificity protein phosphatase, putative 0.066 0.8164 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0146 0.0302
Mycobacterium ulcerans metal cation transporter p-type ATPase a 0.0119 0.1282 1
Leishmania major calcium-translocating P-type ATPase 0.0043 0.0308 0.8264
Brugia malayi Membrane calcium atpase protein 3 0.0047 0.0363 0.075
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0043 0.0308 0.0363
Schistosoma mansoni hypothetical protein 0.0198 0.2279 0.2279
Echinococcus multilocularis calcium transporting ATPase type 2C member 0.0047 0.0363 0.0363
Schistosoma mansoni lamin 0.0028 0.0129 0.0129
Plasmodium vivax calcium-transporting ATPase, putative 0.0047 0.0363 1
Schistosoma mansoni Na+/K+ transporting ATPase subunit alpha 0.0124 0.1338 0.1338
Plasmodium vivax SET domain protein, putative 0.0032 0.0167 0.3841
Brugia malayi haloacid dehalogenase-like hydrolase family protein 0.0024 0.0068 0.014
Echinococcus granulosus nervana 2 0.0242 0.2847 0.2847
Loa Loa (eye worm) calcium ATPase 0.0024 0.0068 0.014
Echinococcus multilocularis nervana 2 0.0242 0.2847 0.2847
Brugia malayi calcium ATPase 0.0024 0.0068 0.014
Entamoeba histolytica rodhanase-like domain containing protein 0.0064 0.0586 0.0704
Brugia malayi Sodium/potassium-transporting ATPase alpha-3 chain, putative 0.0023 0.0062 0.0128
Loa Loa (eye worm) hypothetical protein 0.0059 0.0522 0.1078
Onchocerca volvulus 0.0064 0.0586 0.1622
Brugia malayi Intermediate filament tail domain containing protein 0.0028 0.0129 0.0265
Brugia malayi Calcitonin receptor-like protein seb-1 0.0058 0.0505 0.1043
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0043 0.0308 0.8425
Loa Loa (eye worm) hypothetical protein 0.0058 0.0505 0.1043
Brugia malayi latrophilin 2 splice variant baaae 0.004 0.0271 0.056
Trypanosoma brucei vacuolar-type Ca2+-ATPase, putative 0.0043 0.0308 0.8264
Trypanosoma cruzi P-type H+-ATPase, putative 0.0023 0.0062 0.1409
Echinococcus granulosus nervana 2 0.02 0.2314 0.2314
Trypanosoma cruzi P-type H+-ATPase, putative 0.0023 0.0062 0.1409
Loa Loa (eye worm) hypothetical protein 0.004 0.0271 0.056
Schistosoma mansoni hypothetical protein 0.004 0.0271 0.0271
Entamoeba histolytica plasma membrane calcium ion-transporting ATPase, putative 0.0024 0.0068 0.0068
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0047 0.0363 1
Echinococcus multilocularis m phase inducer phosphatase(cdc25) 0.0064 0.0586 0.0586
Toxoplasma gondii calcium-translocating P-type ATPase, PMCA-type protein 0.0043 0.0308 0.8264
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0047 0.0363 0.0363
Brugia malayi exodeoxyribonuclease III family protein 0.0022 0.0045 0.0093
Loa Loa (eye worm) hypothetical protein 0.0032 0.0167 0.0345
Trichomonas vaginalis cation-transporting ATPase, putative 0.0043 0.0308 0.0324
Echinococcus granulosus calcium transporting ATPase type 2C member 0.0047 0.0363 0.0363
Onchocerca volvulus 0.0064 0.0586 0.1622
Trypanosoma brucei vacuolar-type Ca2+-ATPase 2 0.0043 0.0308 0.8264
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0167 0.0167
Echinococcus granulosus sarco:endoplasmic reticulum calcium ATPase 0.0043 0.0308 0.0308
Onchocerca volvulus 0.0032 0.0167 0.0137
Echinococcus multilocularis plasma membrane calcium transporting ATPase 0.0047 0.0363 0.0363
Echinococcus multilocularis lamin 0.0028 0.0129 0.0129
Loa Loa (eye worm) hypothetical protein 0.0242 0.2847 0.5878
Echinococcus multilocularis microtubule associated protein 2 0.0805 1 1
Loa Loa (eye worm) hypothetical protein 0.0083 0.0819 0.1691
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0043 0.0308 0.2035
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.003 0.0153 0.0153
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0022 0.0045 0.5
Brugia malayi Na,K-ATPase alpha subunit 0.0124 0.1338 0.2762
Echinococcus multilocularis Tetracycline resistance leader peptide, TetL 0.0047 0.0363 0.0363
Trichomonas vaginalis pps1 dual specificty phosphatase, putative 0.066 0.8164 1
Brugia malayi calcium ATPase 0.0023 0.0062 0.0128
Loa Loa (eye worm) hypothetical protein 0.0124 0.1338 0.2762
Trypanosoma brucei calcium-translocating P-type ATPase 0.0047 0.0363 1
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0399 0.4843 0.4843
Mycobacterium tuberculosis Possible metal cation transporting P-type ATPase CtpH 0.0026 0.0091 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0058 0.0505 0.1043
Leishmania major calcium motive p-type ATPase, putative 0.0047 0.0363 1
Mycobacterium ulcerans metal cation-transporting p-type ATPase F, CtpF 0.0047 0.0363 0.2573
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0022 0.0045 0.0093
Mycobacterium leprae PROBABLE CATION-TRANSPORTER ATPASE I CTPI 0.0102 0.1065 0.5
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.02 0.2314 0.2314
Schistosoma mansoni lamin 0.0028 0.0129 0.0129
Trypanosoma brucei P-type H+-ATPase, putative 0.0023 0.0062 0.0529
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0242 0.2847 0.2847
Loa Loa (eye worm) hypothetical protein 0.0059 0.0522 0.1078
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0242 0.2847 0.2847
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0043 0.0308 0.8264
Trichomonas vaginalis mitotic inducer phosphatase CDC25, putative 0.0064 0.0586 0.0667
Echinococcus granulosus Na:K ATPase alpha subunit 0.0124 0.1338 0.1338
Trypanosoma brucei P-type H+-ATPase, putative 0.0023 0.0062 0.0529
Trichomonas vaginalis cdc25c, putative 0.0064 0.0586 0.0667
Plasmodium vivax P-type ATPase4, putative 0.0047 0.0363 1
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0242 0.2847 0.2847
Schistosoma mansoni transmemberane protein 0.0242 0.2847 0.2847
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0047 0.0363 0.0363
Echinococcus granulosus geminin 0.0198 0.2279 0.2279
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0043 0.0308 0.0324
Trypanosoma brucei calcium motive p-type ATPase, putative 0.0047 0.0363 1
Leishmania major P-type ATPase, putative 0.0047 0.0363 1
Brugia malayi Sodium/potassium-transporting ATPase alpha chain, putative 0.0106 0.112 0.2313
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0043 0.0308 0.8264
Loa Loa (eye worm) hypothetical protein 0.0096 0.0987 0.2037
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0022 0.0045 0.0929
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0043 0.0308 0.0324
Leishmania major P-type H -ATPase, putative 0.0023 0.0062 0.0529
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0032 0.0167 0.0167
Brugia malayi Calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0047 0.0363 0.075
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0242 0.2847 0.2847
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0399 0.4843 0.4843
Echinococcus granulosus plasma membrane calcium transporting ATPase 0.0047 0.0363 0.0363
Echinococcus granulosus lamin 0.0028 0.0129 0.0129
Entamoeba histolytica rodhanase-like domain containing protein 0.0064 0.0586 0.0704
Loa Loa (eye worm) sodium potassium adenosine triphosphatase 0.0023 0.0062 0.0128
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.02 0.2314 0.2314
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0047 0.0363 0.0363
Echinococcus multilocularis musashi 0.0028 0.0129 0.0129
Loa Loa (eye worm) hypothetical protein 0.0242 0.2847 0.5878
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0032 0.0167 0.3841
Loa Loa (eye worm) hypothetical protein 0.0077 0.074 0.1529
Echinococcus granulosus m phase inducer phosphatasecdc25 0.0064 0.0586 0.0586
Giardia lamblia Potassium-transporting ATPase alpha chain 1 0.0124 0.1338 1
Toxoplasma gondii P-type ATPase4, putative 0.0047 0.0363 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0122 0.0252
Entamoeba histolytica plasma membrane calcium ion-transporting ATPase, putative 0.0028 0.0117 0.0128
Onchocerca volvulus 0.025 0.295 1
Leishmania major P-type H -ATPase, putative 0.0023 0.0062 0.0529
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0399 0.4843 1
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0043 0.0308 0.0324
Loa Loa (eye worm) hypothetical protein 0.0043 0.0308 0.0636
Loa Loa (eye worm) intermediate filament protein 0.0028 0.0129 0.0265
Echinococcus granulosus histone lysine methyltransferase setb 0.0032 0.0167 0.0167
Echinococcus granulosus calcium transporting atpase 0.0047 0.0363 0.0363
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0167 0.0167
Schistosoma mansoni calcium-transporting atpase 2 (atpase 2) 0.0047 0.0363 0.0363
Entamoeba histolytica calcium-transporting P-type ATPase, putative 0.0047 0.0363 0.0431
Toxoplasma gondii plasma membrane-type Ca(2+)-ATPase A1 PMCAA1 0.0047 0.0363 1
Trichomonas vaginalis mitotic inducer phosphatase CDC25, putative 0.0064 0.0586 0.0667
Toxoplasma gondii sarco/endoplasmic reticulum Ca2+-ATPase 0.0047 0.0363 1
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0043 0.0308 0.0363
Echinococcus granulosus lamin dm0 0.0028 0.0129 0.0129
Echinococcus multilocularis lamin dm0 0.0028 0.0129 0.0129
Trichomonas vaginalis cation-transporting ATPase fungi, putative 0.0043 0.0308 0.0324
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0032 0.0167 0.0167
Trichomonas vaginalis cdc25b, putative 0.0064 0.0586 0.0667
Echinococcus granulosus sodium:potassium transporting ATPase subunit 0.0242 0.2847 0.2847
Echinococcus multilocularis nervana 2 0.0242 0.2847 0.2847
Loa Loa (eye worm) hypothetical protein 0.0023 0.0062 0.0128
Trichomonas vaginalis cation-transporting ATPase, putative 0.0043 0.0308 0.0324
Schistosoma mansoni na+/k+ atpase alpha subunit 0.0124 0.1338 0.1338

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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