Detailed information for compound 152812

Basic information

Technical information
  • TDR Targets ID: 152812
  • Name: 4-[3-butanoyl-4-(2,6-dimethylanilino)quinolin -8-yl]oxybutanamide
  • MW: 419.516 | Formula: C25H29N3O3
  • H donors: 2 H acceptors: 3 LogP: 4.7 Rotable bonds: 10
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCC(=O)c1cnc2c(c1Nc1c(C)cccc1C)cccc2OCCCC(=O)N
  • InChi: 1S/C25H29N3O3/c1-4-8-20(29)19-15-27-25-18(11-6-12-21(25)31-14-7-13-22(26)30)24(19)28-23-16(2)9-5-10-17(23)3/h5-6,9-12,15H,4,7-8,13-14H2,1-3H3,(H2,26,30)(H,27,28)
  • InChiKey: FSWDNRRZCWHEFS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-[[3-butanoyl-4-(2,6-dimethylanilino)-8-quinolyl]oxy]butanamide
  • 4-[[4-(2,6-dimethylanilino)-3-(1-oxobutyl)-8-quinolyl]oxy]butanamide
  • 4-[3-butanoyl-4-[(2,6-dimethylphenyl)amino]quinolin-8-yl]oxybutanamide
  • 4-[[3-butyryl-4-(2,6-dimethylanilino)-8-quinolyl]oxy]butyramide
  • 4-[[3-butanoyl-4-[(2,6-dimethylphenyl)amino]-8-quinolyl]oxy]butanamide
  • 4-[[4-[(2,6-dimethylphenyl)amino]-3-(1-oxobutyl)-8-quinolyl]oxy]butanamide
  • 4-[[3-butyryl-4-[(2,6-dimethylphenyl)amino]-8-quinolyl]oxy]butyramide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Sus scrofa Potassium-transporting ATPase Starlite/ChEMBL 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
Echinococcus multilocularis nervana 2 Potassium-transporting ATPase   290 aa 265 aa 22.3 %
Schistosoma japonicum Sodium/potassium-transporting ATPase subunit beta, putative Potassium-transporting ATPase   290 aa 256 aa 25.4 %
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit Potassium-transporting ATPase   290 aa 266 aa 24.1 %
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit Potassium-transporting ATPase   290 aa 254 aa 23.6 %
Echinococcus granulosus sodium:potassium dependent atpase beta subunit Potassium-transporting ATPase   290 aa 266 aa 25.6 %
Echinococcus granulosus nervana 2 Potassium-transporting ATPase   290 aa 280 aa 29.3 %
Echinococcus granulosus sodium:potassium dependent atpase beta subunit Potassium-transporting ATPase   290 aa 267 aa 27.3 %
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit Potassium-transporting ATPase   290 aa 306 aa 26.1 %
Onchocerca volvulus Glutamate carboxypeptidase 2 homolog Potassium-transporting ATPase   290 aa 301 aa 25.9 %
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit Potassium-transporting ATPase   290 aa 267 aa 27.3 %
Loa Loa (eye worm) hypothetical protein Potassium-transporting ATPase   290 aa 301 aa 25.9 %
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit Potassium-transporting ATPase   290 aa 267 aa 21.3 %
Schistosoma japonicum Sodium/potassium-transporting ATPase subunit beta-1, putative Potassium-transporting ATPase   290 aa 258 aa 24.4 %
Schistosoma japonicum ko:K01540 Na+/K+-exchanging ATPase beta subunit [EC3.6.3.9B], putative Potassium-transporting ATPase   290 aa 258 aa 23.6 %
Drosophila melanogaster nervana 1 Potassium-transporting ATPase   290 aa 305 aa 23.9 %
Echinococcus multilocularis nervana 2 Potassium-transporting ATPase   290 aa 280 aa 29.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) hypothetical protein 0.0953 0.0972 0.3685
Loa Loa (eye worm) calcium ATPase 0.001 0.0002 0.0008
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0017 0.001 0.0102
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0017 0.001 0.0102
Brugia malayi Regulator of G protein signaling domain containing protein 0.0953 0.0972 0.3685
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0014 0.0006 0.0017
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Brugia malayi Protein kinase c protein 2 0.0047 0.004 0.0153
Echinococcus multilocularis Ca2+ transporting ATPase plasma membrane 0.0014 0.0006 0.0004
Echinococcus granulosus calcium transporting atpase 0.0014 0.0006 0.0004
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Entamoeba histolytica plasma membrane calcium ion-transporting ATPase, putative 0.001 0.0002 0.0023
Schistosoma mansoni na+/k+ atpase alpha subunit 0.0014 0.0006 0.0017
Schistosoma mansoni serine/threonine protein kinase 0.0016 0.0009 0.0028
Schistosoma mansoni sodium / potassium ATPase beta chain 0.0026 0.0019 0.0064
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0026 0.0019 0.0064
Entamoeba histolytica protein kinase, putative 0.0009 0.0002 0.002
Leishmania major calcium motive p-type ATPase, putative 0.0014 0.0006 0.0303
Schistosoma mansoni ATPase 0.0017 0.001 0.003
Schistosoma mansoni serine/threonine protein kinase 0.0055 0.0049 0.0178
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0953 0.0972 0.3681
Onchocerca volvulus 0.0103 0.0098 1
Loa Loa (eye worm) hypothetical protein 0.0953 0.0972 0.3685
Trichomonas vaginalis cation-transporting ATPase, putative 0.0017 0.001 0.0094
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.001 0.0094
Loa Loa (eye worm) sodium/potassium-transporting ATPase subunit alpha 0.0012 0.0004 0.0016
Brugia malayi Protein kinase domain containing protein 0.0009 0.0002 0.0007
Brugia malayi PXA domain containing protein 0.0953 0.0972 0.3685
Echinococcus granulosus regulator of G protein signaling 3 0.2572 0.2636 0.2635
Brugia malayi Protein kinase domain containing protein 0.0009 0.0002 0.0007
Trypanosoma brucei vacuolar-type Ca2+-ATPase 1 0.0017 0.001 0.0934
Schistosoma mansoni serine/threonine protein kinase 0.0954 0.0973 0.3685
Echinococcus granulosus Regulator of G protein signaling 20 0.0953 0.0972 0.097
Echinococcus multilocularis regulator of G protein signaling 0.2572 0.2636 0.2635
Trichomonas vaginalis regulator of G protein signaling 5, rgs5, putative 0.0953 0.0972 1
Brugia malayi intracellular kinase 0.0103 0.0098 0.0373
Brugia malayi Membrane calcium atpase protein 3 0.0014 0.0006 0.0024
Echinococcus multilocularis nervana 2 0.0026 0.0019 0.0017
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0009 0.0002 0.0007
Echinococcus multilocularis regulator of G protein signaling 7 0.0953 0.0972 0.097
Brugia malayi hypothetical protein 0.0953 0.0972 0.3685
Echinococcus multilocularis sarco:endoplasmic reticulum calcium ATPase 0.0017 0.001 0.0008
Brugia malayi protein kinase C II. 0.0016 0.0009 0.0035
Brugia malayi PXA domain containing protein 0.0953 0.0972 0.3685
Plasmodium falciparum glycogen synthase kinase 3 0.0103 0.0098 1
Schistosoma mansoni regulator of G protein signaling 0.2572 0.2636 1
Schistosoma mansoni regulator of G protein signaling 0.0953 0.0972 0.3681
Entamoeba histolytica hypothetical protein 0.0953 0.0972 1
Echinococcus granulosus Protein kinase C brain isozyme 0.0055 0.0049 0.0047
Trichomonas vaginalis conserved hypothetical protein 0.0953 0.0972 1
Echinococcus multilocularis regulator of G protein signaling 3 0.2572 0.2636 0.2635
Loa Loa (eye worm) hypothetical protein 0.2572 0.2636 1
Brugia malayi Na,K-ATPase alpha subunit 0.0017 0.001 0.0037
Trichomonas vaginalis conserved hypothetical protein 0.0953 0.0972 1
Echinococcus granulosus regulator of G protein signaling 3 0.2572 0.2636 0.2635
Trichomonas vaginalis cation-transporting ATPase, putative 0.0011 0.0003 0.0029
Loa Loa (eye worm) E1-E2 ATPase 0.0011 0.0003 0.0013
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0026 0.0019 0.0064
Trypanosoma brucei vacuolar-type Ca2+-ATPase 2 0.0017 0.001 0.0934
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.001 0.0094
Echinococcus multilocularis nervana 2 0.0026 0.0019 0.0017
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Brugia malayi regulator of G-protein signaling rgs-7 0.2572 0.2636 1
Loa Loa (eye worm) calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0008 0.0001 0.0003
Echinococcus multilocularis sodium:potassium transporting ATPase subunit 0.0026 0.0019 0.0017
Schistosoma mansoni serine/threonine protein kinase 0.0954 0.0973 0.3685
Plasmodium falciparum non-SERCA-type Ca2+ -transporting P-ATPase 0.0017 0.001 0.038
Entamoeba histolytica protein kinase, putative 0.0009 0.0002 0.002
Entamoeba histolytica protein kinase, putative 0.0009 0.0002 0.002
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0103 0.0098 0.0096
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0009 0.0002 0.0007
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0103 0.0098 0.0373
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Onchocerca volvulus 0.0026 0.0019 0.1
Schistosoma mansoni Na+/K+ transporting ATPase subunit alpha 0.0017 0.001 0.003
Toxoplasma gondii plasma membrane-type Ca(2+)-ATPase A1 PMCAA1 0.0014 0.0006 0.0648
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0009 0.0002 0.0007
Loa Loa (eye worm) hypothetical protein 0.0017 0.001 0.0037
Brugia malayi Probable calcium-transporting ATPase KIAA0703 0.0008 0.0001 0.0003
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0026 0.0019 0.0017
Schistosoma mansoni transmemberane protein 0.0026 0.0019 0.0064
Schistosoma mansoni regulator of G protein signaling 0.0953 0.0972 0.3681
Toxoplasma gondii AGC kinase 0.0009 0.0002 0.0196
Echinococcus granulosus nervana 2 0.0026 0.0019 0.0017
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0009 0.0002 0.0007
Schistosoma mansoni atypical protein kinase C 0.0015 0.0008 0.0023
Echinococcus granulosus regulator of G protein signaling 7 0.0953 0.0972 0.097
Loa Loa (eye worm) hypothetical protein 0.0026 0.0019 0.0071
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0103 0.0098 1
Trichomonas vaginalis conserved hypothetical protein 0.0953 0.0972 1
Echinococcus multilocularis RNA directed DNA polymerase 0.0038 0.0032 0.003
Entamoeba histolytica protein kinase domain containing protein 0.0103 0.0098 0.1012
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0014 0.0006 0.0017
Echinococcus granulosus Ca2 transporting ATPase plasma membrane 0.0014 0.0006 0.0004
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Loa Loa (eye worm) hypothetical protein 0.0953 0.0972 0.3685
Entamoeba histolytica hypothetical protein 0.0953 0.0972 1
Echinococcus multilocularis protein kinase shaggy 0.0103 0.0098 0.0096
Echinococcus multilocularis axis inhibition protein axin 0.0953 0.0972 0.097
Echinococcus multilocularis regulator of G protein signaling 7 0.0953 0.0972 0.097
Echinococcus multilocularis protein kinase c epsilon type 0.0016 0.0009 0.0007
Trypanosoma brucei vacuolar-type Ca2+-ATPase, putative 0.0017 0.001 0.0934
Echinococcus granulosus axis inhibition protein axin 0.0953 0.0972 0.097
Loa Loa (eye worm) AGC/PKN protein kinase 0.0009 0.0002 0.0007
Echinococcus multilocularis axis inhibition protein axin 0.0953 0.0972 0.097
Schistosoma mansoni ATPase 0.0017 0.001 0.003
Echinococcus multilocularis expressed protein 0.9735 1 1
Schistosoma mansoni z-protein (S1r protein) 0.0953 0.0972 0.3681
Trypanosoma brucei rac serine-threonine kinase, putative 0.0009 0.0002 0.012
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0103 0.0098 0.0096
Loa Loa (eye worm) hypothetical protein 0.0953 0.0972 0.3685
Trichomonas vaginalis cation-transporting ATPase, putative 0.0017 0.001 0.0094
Echinococcus granulosus axis inhibition protein axin 0.0953 0.0972 0.097
Entamoeba histolytica plasma membrane calcium-transporting ATPase 1, putative 0.001 0.0002 0.0023
Entamoeba histolytica hypothetical protein 0.0953 0.0972 1
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0017 0.001 0.1004
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.001 0.0094
Brugia malayi Protein kinase domain containing protein 0.0009 0.0002 0.0007
Echinococcus multilocularis regulator of G protein signaling 3 0.2572 0.2636 0.2635
Echinococcus granulosus calcium transporting ATPase type 2C member 0.0017 0.001 0.0008
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0014 0.0006 0.0648
Leishmania major calcium-translocating P-type ATPase 0.0017 0.001 0.0672
Echinococcus granulosus sodium:potassium transporting ATPase subunit 0.0026 0.0019 0.0017
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0103 0.0098 0.0373
Trichomonas vaginalis conserved hypothetical protein 0.0953 0.0972 1
Trichomonas vaginalis conserved hypothetical protein 0.0953 0.0972 1
Trypanosoma cruzi P-type H+-ATPase, putative 0.0011 0.0003 0.0356
Brugia malayi A-kinase anchor protein 10, precursor 0.0953 0.0972 0.3685
Echinococcus multilocularis beta adrenergic receptor kinase 0.0954 0.0973 0.0971
Loa Loa (eye worm) hypothetical protein 0.0038 0.0032 0.0121
Brugia malayi Sodium/potassium-transporting ATPase alpha chain, putative 0.0012 0.0004 0.0016
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0038 0.0032 0.003
Trypanosoma cruzi P-type H+-ATPase, putative 0.0011 0.0003 0.0356
Schistosoma mansoni regulator of G protein signaling 0.2572 0.2636 1
Loa Loa (eye worm) AGC/NDR protein kinase 0.0009 0.0002 0.0007
Loa Loa (eye worm) PXA domain-containing protein 0.0953 0.0972 0.3685
Echinococcus multilocularis Na+:K+ ATPase alpha subunit 0.0014 0.0006 0.0004
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0017 0.001 0.0672
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Toxoplasma gondii P-type ATPase4, putative 0.0017 0.001 0.1004
Schistosoma mansoni regulator of G protein signaling 0.0953 0.0972 0.3681
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Brugia malayi haloacid dehalogenase-like hydrolase family protein 0.001 0.0002 0.0008
Loa Loa (eye worm) AGC/AKT protein kinase 0.0009 0.0002 0.0007
Plasmodium vivax glycogen synthase kinase 3, putative 0.0103 0.0098 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.001 0.0037
Onchocerca volvulus 0.0026 0.0019 0.1
Entamoeba histolytica protein kinase, putative 0.0103 0.0098 0.1012
Trichomonas vaginalis conserved hypothetical protein 0.0953 0.0972 1
Schistosoma mansoni calcium-transporting atpase sarcoplasmic/endoplasmic reticulum type (calcium pump) 0.0014 0.0006 0.0017
Loa Loa (eye worm) hypothetical protein 0.0953 0.0972 0.3685
Brugia malayi Hr1 repeat family protein 0.0009 0.0002 0.0007
Trypanosoma brucei P-type H+-ATPase, putative 0.0011 0.0003 0.0281
Trichomonas vaginalis CMGC family protein kinase 0.0103 0.0098 0.1005
Echinococcus granulosus plasma membrane calcium transporting ATPase 0.0014 0.0006 0.0004
Schistosoma mansoni axis inhibition protein axin 0.0953 0.0972 0.3681
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.001 0.0094
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0103 0.0098 1
Echinococcus granulosus nervana 2 0.0026 0.0019 0.0017
Echinococcus multilocularis serine threonine protein kinase 0.0049 0.0043 0.0041
Giardia lamblia Plasma membrane calcium-transporting ATPase 2 0.0017 0.001 0.038
Echinococcus granulosus sarco:endoplasmic reticulum calcium ATPase 0.0017 0.001 0.0008
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0055 0.0049 0.0047
Echinococcus multilocularis protein kinase c iota type 0.0015 0.0008 0.0006
Entamoeba histolytica calcium-transporting P-type ATPase, putative 0.0017 0.001 0.0102
Schistosoma mansoni regulator of G protein signaling 3 rgs3 0.0953 0.0972 0.3681
Giardia lamblia Kinase, CMGC GSK 0.0103 0.0098 1
Trichomonas vaginalis cation-transporting ATPase, putative 0.0017 0.001 0.0094
Trichomonas vaginalis cation-transporting ATPase fungi, putative 0.0017 0.001 0.0094
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Trypanosoma cruzi calcium-transporting ATPase, putative 0.0008 0.0001 0.0076
Echinococcus granulosus protein kinase shaggy 0.0103 0.0098 0.0096
Loa Loa (eye worm) Na,K-ATPase alpha subunit 0.0017 0.001 0.0037
Leishmania major calcium-transporting ATPase, putative 0.0014 0.0006 0.0303
Echinococcus multilocularis nervana 2 0.0026 0.0019 0.0017
Mycobacterium ulcerans metal cation transporter p-type ATPase a 0.0017 0.001 1
Echinococcus multilocularis A kinase anchor protein 10, mitochondrial 0.0953 0.0972 0.097
Echinococcus granulosus protein kinase c iota type 0.0015 0.0008 0.0006
Trichomonas vaginalis CMGC family protein kinase 0.0103 0.0098 0.1005
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0026 0.0019 0.0017
Loa Loa (eye worm) G protein signaling regulator EGL-10 0.0953 0.0972 0.3685
Loa Loa (eye worm) AGC/GRK/GRK protein kinase 0.0954 0.0973 0.369
Echinococcus multilocularis calcium transporting ATPase type 2C member 0.0017 0.001 0.0008
Echinococcus granulosus Na:K ATPase alpha subunit 0.0014 0.0006 0.0004
Echinococcus multilocularis nervana 2 0.0026 0.0019 0.0017
Schistosoma mansoni axis inhibition protein axin 0.0953 0.0972 0.3681
Mycobacterium tuberculosis Possible metal cation transporting P-type ATPase CtpH 0.0012 0.0004 0.5
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0016 0.0009 0.0035
Echinococcus granulosus nervana 2 0.0026 0.0019 0.0017
Schistosoma mansoni regulator of G protein signaling 17 19 20 (rgs17 19 20) 0.0953 0.0972 0.3681
Toxoplasma gondii P-type ATPase PMA1 0.0011 0.0003 0.0356
Brugia malayi Probable G protein-coupled receptor kinase F19C6.1, putative 0.0954 0.0973 0.369
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.0041 0.0034 0.013
Echinococcus granulosus A kinase anchor protein 10 mitochondrial 0.0953 0.0972 0.097
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0017 0.001 0.0094
Echinococcus granulosus RNA directed DNA polymerase 0.0038 0.0032 0.003
Echinococcus multilocularis calcium transporting atpase 0.0014 0.0006 0.0004
Schistosoma mansoni plasma membrane calcium-transporting atpase 0.0014 0.0006 0.0017
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0103 0.0098 1
Schistosoma mansoni serine/threonine protein kinase 0.0055 0.0049 0.0178
Trichomonas vaginalis AGC family protein kinase 0.0009 0.0002 0.0012
Loa Loa (eye worm) AGC/GRK/BARK protein kinase 0.0954 0.0973 0.369
Echinococcus granulosus protein kinase C gamma type 0.0049 0.0043 0.0041
Echinococcus multilocularis Regulator of G protein signaling 20 0.0953 0.0972 0.097
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0026 0.0019 0.0017
Mycobacterium ulcerans metal cation-transporting p-type ATPase F, CtpF 0.0017 0.001 1
Trichomonas vaginalis plasma membrane calcium-transporting ATPase, putative 0.0014 0.0006 0.0058
Trypanosoma brucei P-type H+-ATPase, putative 0.0011 0.0003 0.0281
Entamoeba histolytica protein kinase, putative 0.0009 0.0002 0.002
Trypanosoma brucei calcium-translocating P-type ATPase 0.0014 0.0006 0.0576
Loa Loa (eye worm) hypothetical protein 0.0008 0.0001 0.0003
Entamoeba histolytica protein kinase domain containing protein 0.0103 0.0098 0.1012
Mycobacterium leprae PROBABLE CATION-TRANSPORTER ATPASE I CTPI 0.0012 0.0004 0.5
Leishmania major P-type ATPase, putative 0.0014 0.0006 0.0303
Echinococcus multilocularis plasma membrane calcium transporting ATPase 0.0014 0.0006 0.0004
Toxoplasma gondii calcium-translocating P-type ATPase, PMCA-type protein 0.0017 0.001 0.1004
Brugia malayi hypothetical protein 0.0953 0.0972 0.3685
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0026 0.0019 0.0017
Trypanosoma brucei calcium motive p-type ATPase, putative 0.0014 0.0006 0.0576
Schistosoma mansoni calcium-transporting atpase 2 (atpase 2) 0.0014 0.0006 0.0017
Echinococcus multilocularis Tetracycline resistance leader peptide, TetL 0.0017 0.001 0.0008
Echinococcus granulosus beta-adrenergic receptor kinase 0.0954 0.0973 0.0971
Echinococcus granulosus sodium:potassium dependent atpase beta subunit 0.0026 0.0019 0.0017
Brugia malayi p70 ribosomal S6 kinase beta 0.0009 0.0002 0.0007
Echinococcus granulosus nervana 2 0.0026 0.0019 0.0017
Echinococcus granulosus plasma membrane calcium transporting ATPase 2 0.0017 0.001 0.0008
Toxoplasma gondii sarco/endoplasmic reticulum Ca2+-ATPase 0.0017 0.001 0.1004
Schistosoma mansoni sodium/potassium-dependent atpase beta subunit 0.0026 0.0019 0.0064
Echinococcus multilocularis sodium:potassium dependent atpase beta subunit 0.0026 0.0019 0.0017
Echinococcus granulosus regulator of G protein signaling 7 0.0953 0.0972 0.097
Trypanosoma cruzi Calcium ATPase SERCA-like 0.0017 0.001 0.1004
Loa Loa (eye worm) RGS-3 protein 0.0953 0.0972 0.3685
Brugia malayi E1-E2 ATPase family protein 0.0011 0.0003 0.0013
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0103 0.0098 0.0366
Leishmania major vacuolar-type Ca2 -ATPase, putative 0.0017 0.001 0.0672
Giardia lamblia Kinase, CMGC GSK 0.0103 0.0098 1
Brugia malayi regulator of G-protein signaling egl-10 0.0953 0.0972 0.3685
Entamoeba histolytica Plasma membrane calcium-transporting ATPase, putative 0.0017 0.001 0.0102
Loa Loa (eye worm) hypothetical protein 0.0026 0.0019 0.0071
Trypanosoma brucei protein kinase, putative 0.0103 0.0098 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0007
Brugia malayi Calcium-transporting ATPase sarcoplasmic/endoplasmic reticulum type 0.0014 0.0006 0.0024
Schistosoma mansoni serine/threonine protein kinase 0.0954 0.0973 0.3685
Trypanosoma cruzi plasma membrane Ca2+ ATPase 0.0017 0.001 0.1004
Trypanosoma cruzi calcium motive p-type ATPase, putative 0.0014 0.0006 0.0648
Echinococcus granulosus protein kinase c epsilon type 0.0016 0.0009 0.0007
Brugia malayi Regulator of G protein signaling domain containing protein 0.0953 0.0972 0.3685
Loa Loa (eye worm) hypothetical protein 0.0044 0.0038 0.0144

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 2.2 uM Inhibition of K+ -stimulated gastric ATPase activity was measured using lyophilized gastric vesicles at pH 7 ChEMBL. 7629813
IC50 (binding) = 2.2 uM Inhibition of K+ -stimulated gastric ATPase activity was measured using lyophilized gastric vesicles at pH 7 ChEMBL. 7629813
Inhibition (functional) = 72 % Inhibition of pentagastrin-stimulated gastric acid secretion at a single dose of 10 micromol/kg. ChEMBL. 7629813
Inhibition (functional) = 72 % Inhibition of pentagastrin-stimulated gastric acid secretion at a single dose of 10 micromol/kg. ChEMBL. 7629813

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

1 literature reference was collected for this gene.

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