Detailed information for compound 1185279

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 383.914 | Formula: C22H26ClN3O
  • H donors: 0 H acceptors: 1 LogP: 5.28 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: C1CCN(CC1)c1ccc2c(c1)[o+]c1c(n2)ccc(c1)N1CCCCC1.[Cl-]
  • InChi: 1S/C22H26N3O.ClH/c1-3-11-24(12-4-1)17-7-9-19-21(15-17)26-22-16-18(8-10-20(22)23-19)25-13-5-2-6-14-25;/h7-10,15-16H,1-6,11-14H2;1H/q+1;/p-1
  • InChiKey: SQQPKDWHARNTKY-UHFFFAOYSA-M  


Substructure search Similarity search

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
Brugia malayi hypothetical protein 0.00483868 0.03895 0.039939
Schistosoma mansoni GMP synthetase 0.00703642 0.114892 0.071128
Leishmania major AMP deaminase, putative,amp deaminase-like protein 0.0319347 0.975237 1
Schistosoma mansoni glyceraldehyde-3-phosphate dehydrogenase (phosphorylating) 0.0127598 0.312661 0.284649
Schistosoma mansoni phosphatidylinositol 4-kinase 0.00731022 0.124353 0.0813429
Echinococcus multilocularis sodium:nucleoside cotransporter 2 0.0213153 0.60829 0.592414
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.00512984 0.049011 0.0104687
Echinococcus multilocularis phosphatidylinositol 4 kinase alpha 0.00731022 0.124353 0.0888642
Loa Loa (eye worm) glyceraldehyde-3-phosphate dehydrogenase 0.00904834 0.184413 0.168058
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.00512984 0.049011 0.0502554
Loa Loa (eye worm) phosphatidylinositol 4-kinase type 3 alpha isoform 1 0.00731022 0.124353 0.104875
Echinococcus granulosus adenosine kinase 0.0161324 0.429199 0.406065
Echinococcus multilocularis 0.0064407 0.0943071 0.0576006
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.00512984 0.049011 0.0107456
Trypanosoma brucei glyceraldehyde-3-phosphate dehydrogenase, putative 0.00794648 0.146338 0.10508
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 1
Entamoeba histolytica AMP deaminase, putative 0.0319347 0.975237 1
Schistosoma mansoni phosphatidylinositol 4-kinase type-II 0.0276112 0.825842 0.838705
Trichomonas vaginalis adenosine deaminase, putative 0.0113854 0.265169 0.838775
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.00731022 0.124353 0.12751
Onchocerca volvulus 0.0276112 0.825842 0.840438
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.00512984 0.049011 0.104968
Trypanosoma brucei glyceraldehyde 3-phosphate dehydrogenase, glycosomal 0.0127598 0.312661 0.284649
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, cytosolic, putative 0.0127598 0.312661 0.320599
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.00512984 0.049011 0.0502554
Leishmania major adenine aminohydrolase 0.0113854 0.265169 0.233375
Trypanosoma brucei adenosine kinase, putative 0.0161324 0.429199 0.41047
Echinococcus multilocularis glyceraldehyde 3 phosphate dehydrogenase 0.00852481 0.166322 0.132534
Brugia malayi Adenosine/AMP deaminase family protein 0.0113854 0.265169 0.271902
Echinococcus multilocularis adenosine kinase 0.0161324 0.429199 0.406065
Schistosoma mansoni adenosine kinase 0.0161324 0.429199 0.41047
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 1
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 0.320599
Echinococcus granulosus glyceraldehyde 3 phosphate dehydrogenase 0.0127598 0.312661 0.284804
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.00512984 0.049011 0.104968
Entamoeba histolytica glyceraldehyde-3-phosphate dehydrogenase, putative 0.0127598 0.312661 0.292336
Entamoeba histolytica hypothetical protein 0.00512984 0.049011 0.0107456
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.00512984 0.049011 0.0107456
Toxoplasma gondii glyceraldehyde-3-phosphate dehydrogenase GAPDH1 0.0127598 0.312661 0.284649
Echinococcus granulosus AMP deaminase 2 0.0319347 0.975237 0.974234
Entamoeba histolytica glyceraldehyde-3-phosphate dehydrogenase, putative 0.0127598 0.312661 0.292336
Brugia malayi Adenosine kinase-like 0.0161324 0.429199 0.440097
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, cytosolic, putative 0.0127598 0.312661 0.320599
Entamoeba histolytica adenosine deaminase, putative 0.0113854 0.265169 0.241612
Plasmodium falciparum AMP deaminase, putative 0.0319347 0.975237 1
Leishmania major phosphatidylinositol 4-kinase, putative 0.0064407 0.0943071 0.0489039
Schistosoma mansoni glyceraldehyde-3-phosphate dehydrogenase (phosphorylating) 0.0127598 0.312661 0.284649
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.00512984 0.049011 0.104968
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0064407 0.0943071 0.0967016
Loa Loa (eye worm) phosphatidylinositol kinase 0.0276112 0.825842 0.842837
Loa Loa (eye worm) glyceraldehyde 3-phosphate dehydrogenase 0.00852481 0.166322 0.149026
Trypanosoma cruzi phosphatidylinositol 4-kinase alpha, putative 0.00731022 0.124353 0.12751
Loa Loa (eye worm) hypothetical protein 0.00852481 0.166322 0.149026
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.00512984 0.049011 0.0502554
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0276112 0.825842 0.818783
Echinococcus granulosus adenosine deaminase 0.0113854 0.265169 0.235387
Echinococcus granulosus glyceraldehyde 3 phosphate dehydrogenase 0.0127598 0.312661 0.284804
Trypanosoma brucei adenosine monophosphate deaminase, putative 0.0319347 0.975237 1
Echinococcus multilocularis solute carrier family 28 0.0326513 1 1
Trypanosoma cruzi AMP deaminase, putative 0.0319347 0.975237 1
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0276112 0.825842 0.846811
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.00512984 0.049011 0.0502554
Echinococcus multilocularis glyceraldehyde 3 phosphate dehydrogenase 0.0127598 0.312661 0.284804
Loa Loa (eye worm) hypothetical protein 0.0113854 0.265169 0.253012
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 1
Echinococcus granulosus phosphatidylinositol 4 kinase alpha 0.00731022 0.124353 0.0888642
Echinococcus multilocularis adenosine deaminase 0.0113854 0.265169 0.235387
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 0.320599
Toxoplasma gondii Adenosine/AMP deaminase domain-containing protein 0.0113854 0.265169 0.233375
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.00840042 0.162024 0.122014
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0276112 0.825842 0.818783
Loa Loa (eye worm) hypothetical protein 0.00483868 0.03895 0.0150318
Schistosoma mansoni adenosine deaminase 0.0113854 0.265169 0.233375
Onchocerca volvulus Dipeptidyl peptidase family member 1 homolog 0.0170547 0.461068 0.450842
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.00512984 0.049011 0.104968
Brugia malayi hypothetical protein 0.00442516 0.0246612 0.0252874
Plasmodium vivax phosphatidylinositol 4-kinase, putative 0.0064407 0.0943071 0.0489039
Plasmodium falciparum GMP synthase [glutamine-hydrolyzing] 0.00703642 0.114892 0.071128
Entamoeba histolytica adenosine deaminase, putative 0.0113854 0.265169 0.241612
Loa Loa (eye worm) hypothetical protein 0.0113854 0.265169 0.253012
Loa Loa (eye worm) hypothetical protein 0.00483868 0.03895 0.0150318
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.00512984 0.049011 0.104968
Echinococcus multilocularis Dipeptidyl peptidase 9 0.00562303 0.066053 0.0282014
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.00483868 0.03895 0.070813
Schistosoma mansoni phosphatidylinositol 4-kinase 0.0064407 0.0943071 0.0489039
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.00483868 0.03895 0.070813
Leishmania major phosphatidylinositol 4-kinase alpha, putative 0.00731022 0.124353 0.0813429
Brugia malayi prolyl oligopeptidase family protein 0.00562303 0.066053 0.0677301
Plasmodium vivax glyceraldehyde-3-phosphate dehydrogenase, putative 0.0127598 0.312661 0.284649
Leishmania major glyceraldehyde-3-phosphate dehydrogenase-like protein 0.00794648 0.146338 0.10508
Echinococcus multilocularis glyceraldehyde 3 phosphate dehydrogenase 0.0127598 0.312661 0.284804
Leishmania major AMP deaminase, putative,adenosine monophosphate deaminase-like protein 0.0319347 0.975237 1
Entamoeba histolytica phosphatidylinositol 4-kinase, putative 0.00731022 0.124353 0.0912144
Plasmodium falciparum adenosine deaminase 0.0113854 0.265169 0.233375
Toxoplasma gondii glyceraldehyde-3-phosphate dehydrogenase GAPDH2 0.0127598 0.312661 0.284649
Echinococcus multilocularis Zinc finger, PHD finger 0.00512984 0.049011 0.0104687
Onchocerca volvulus AMP deaminase 2 homolog 0.0319347 0.975237 1
Loa Loa (eye worm) AMP deaminase 0.0319347 0.975237 1
Trypanosoma brucei glyceraldehyde 3-phosphate dehydrogenase, cytosolic 0.0127598 0.312661 0.284649
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.00483868 0.03895 0.070813
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.00512984 0.049011 0.0502554
Leishmania major dipeptidyl-peptidase 8-like serine peptidase, putative,serine peptidase, Clan SC, Family S9B 0.00562303 0.066053 0.0183994
Echinococcus granulosus concentrative Na nucleoside cotransporter 0.0326513 1 1
Echinococcus granulosus phosphatidylinositol 3 kinase catalytic subunit 0.00512984 0.049011 0.0104687
Schistosoma mansoni AMP deaminase 0.0319347 0.975237 1
Echinococcus multilocularis GMP synthase (glutamine hydrolyzing) 0.00703642 0.114892 0.0790194
Trypanosoma brucei AMP deaminase, putative 0.0319347 0.975237 1
Trypanosoma cruzi adenosine monophosphate deaminase-like protein, putative 0.0319347 0.975237 1
Trypanosoma cruzi AMP deaminase, putative 0.0319347 0.975237 1
Plasmodium vivax adenosine deaminase, putative 0.0113854 0.265169 0.233375
Brugia malayi prolyl oligopeptidase family protein 0.0170547 0.461068 0.472775
Toxoplasma gondii kinase, pfkB family protein 0.0161324 0.429199 0.41047
Loa Loa (eye worm) glyceraldehyde-3-phosphate dehydrogenase 0.00904834 0.184413 0.168058
Mycobacterium leprae Probable adenosine deaminase Add (ADENOSINE AMINOHYDROLASE) 0.0113854 0.265169 1
Loa Loa (eye worm) prolyl oligopeptidase 0.0170547 0.461068 0.459097
Entamoeba histolytica AMP deaminase, putative 0.0319347 0.975237 1
Echinococcus multilocularis dipeptidyl aminopeptidaseprotein 0.0170547 0.461068 0.439226
Loa Loa (eye worm) hypothetical protein 0.0276112 0.825842 0.842837
Leishmania major glyceraldehyde 3-phosphate dehydrogenase, glycosomal 0.0127598 0.312661 0.284649
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 0.320599
Schistosoma mansoni adenosine deaminase-related 0.0113854 0.265169 0.233375
Plasmodium falciparum phosphatidylinositol 4-kinase 0.0064407 0.0943071 0.0489039
Leishmania major hypothetical protein, conserved 0.0113854 0.265169 0.233375
Leishmania major AMP deaminase, putative 0.0319347 0.975237 1
Trypanosoma brucei glyceraldehyde 3-phosphate dehydrogenase, glycosomal 0.0127598 0.312661 0.284649
Trypanosoma cruzi glyceraldehyde-3-phosphate dehydrogenase, putative 0.00794648 0.146338 0.150054
Echinococcus granulosus glyceraldehyde 3 phosphate dehydrogenase 0.00852481 0.166322 0.132534
Plasmodium vivax adenosine/AMP deaminase, putative 0.0319347 0.975237 1
Mycobacterium ulcerans glyceraldehyde 3-phosphate dehydrogenase Gap 0.0127598 0.312661 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.00512984 0.049011 0.104968
Treponema pallidum glyceraldehyde 3-phosphate dehydrogenase (gap) 0.0127598 0.312661 1
Mycobacterium tuberculosis Probable adenosine deaminase Add (adenosine aminohydrolase) 0.0113854 0.265169 1
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, cytosolic, putative 0.0127598 0.312661 0.320599
Echinococcus granulosus GMP synthase glutamine hydrolyzing 0.00703642 0.114892 0.0790194
Echinococcus multilocularis AMP deaminase 2 0.0319347 0.975237 0.974234
Schistosoma mansoni glyceraldehyde-3-phosphate dehydrogenase (phosphorylating) 0.0127598 0.312661 0.284649
Brugia malayi Glyceraldehyde 3-phosphate dehydrogenase 0.0127598 0.312661 0.320599
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 0.00512984 0.049011 0.0104687
Trichomonas vaginalis equilibrative nucleoside transporter, putative 0.00483868 0.03895 0.070813
Toxoplasma gondii bifunctional GMP synthase/glutamine amidotransferase protein 0.00703642 0.114892 0.071128
Trypanosoma cruzi AMP deaminase, putative 0.0319347 0.975237 1
Entamoeba histolytica phosphatidylinositol-4,5-bisphosphate 3-kinase, putative 0.00512984 0.049011 0.0107456
Leishmania major GMP synthase, putative,glutamine amidotransferase, putative 0.00703642 0.114892 0.071128
Trypanosoma cruzi serine peptidase, Clan SC, Family S9B 0.00562303 0.066053 0.0677301
Toxoplasma gondii Adenosine/AMP deaminase domain-containing protein 0.0113854 0.265169 0.233375
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.00731022 0.124353 0.360737
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.00512984 0.049011 0.0502554
Echinococcus granulosus solute carrier family 28 0.0326513 1 1
Echinococcus granulosus Dipeptidyl peptidase 9 0.00562303 0.066053 0.0282014
Wolbachia endosymbiont of Brugia malayi glyceraldehyde-3-phosphate dehydrogenase, GapA 0.0127598 0.312661 1
Trypanosoma cruzi AMP deaminase, putative 0.0319347 0.975237 1
Schistosoma mansoni adenosine kinase 0.0161324 0.429199 0.41047
Plasmodium vivax GMP synthetase, putative 0.00703642 0.114892 0.071128
Loa Loa (eye worm) phosphatidylinositol 3 0.0276112 0.825842 0.842837
Trypanosoma cruzi adenosine monophosphate deaminase, putative 0.0319347 0.975237 1
Trypanosoma cruzi glyceraldehyde-3-phosphate dehydrogenase, putative 0.00794648 0.146338 0.150054
Loa Loa (eye worm) glyceraldehyde 3-phosphate dehydrogenase 0.00852481 0.166322 0.149026
Schistosoma mansoni subfamily S9B unassigned peptidase (S09 family) 0.0170547 0.461068 0.444877
Trypanosoma brucei Dipeptidyl-peptidase 8-like, putative 0.00562303 0.066053 0.0183994
Brugia malayi phosphatidylinositol 4-kinase, catalytic, alpha polypeptide 0.00731022 0.124353 0.12751
Schistosoma mansoni glyceraldehyde-3-phosphate dehydrogenase (phosphorylating) 0.0127598 0.312661 0.284649
Plasmodium falciparum glyceraldehyde-3-phosphate dehydrogenase 0.0127598 0.312661 0.284649
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0064407 0.0943071 0.0967016
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.00512984 0.049011 0.0104687
Schistosoma mansoni dipeptidyl-peptidase 9 (S09 family) 0.00562303 0.066053 0.0183994
Trypanosoma brucei AMP deaminase, putative 0.0319347 0.975237 1
Onchocerca volvulus Adenosine deaminase homolog 0.0113854 0.265169 0.241612
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.00512984 0.049011 0.0367577
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.00852481 0.166322 0.503213
Brugia malayi Glyceraldehyde 3-phosphate dehydrogenase 0.00423501 0.0180906 0.01855
Chlamydia trachomatis glyceraldehyde-3-phosphate dehydrogenase 0.0127598 0.312661 0.5
Loa Loa (eye worm) hypothetical protein 0.0161324 0.429199 0.425571
Echinococcus granulosus dipeptidyl aminopeptidaseprotein 0.0170547 0.461068 0.439226
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 0.00512984 0.049011 0.0104687
Trypanosoma cruzi phosphatidylinositol 4-kinase, putative 0.0064407 0.0943071 0.0967016
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0276112 0.825842 0.846811
Loa Loa (eye worm) hypothetical protein 0.00483868 0.03895 0.0150318
Trichomonas vaginalis phosphatidylinositol 4-kinase, putative 0.00731022 0.124353 0.360737
Trypanosoma brucei phosphatidylinositol 4-kinase alpha, putative 0.00731022 0.124353 0.0813429
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.00512984 0.049011 0.104968
Echinococcus granulosus Na+ dependent nucleoside transporter 0.0326513 1 1
Leishmania major adenosine kinase, putative 0.0161324 0.429199 0.41047
Onchocerca volvulus 0.0276112 0.825842 0.840438
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.00512984 0.049011 0.0107456
Leishmania major glyceraldehyde 3-phosphate dehydrogenase, glycosomal 0.0127598 0.312661 0.284649
Mycobacterium ulcerans adenosine deaminase 0.0113854 0.265169 0.759861
Brugia malayi GMP synthase 0.00703642 0.114892 0.117809
Loa Loa (eye worm) phosphatidylinositol 3 0.00512984 0.049011 0.0256158
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.00852481 0.166322 0.503213
Loa Loa (eye worm) hypothetical protein 0.0205493 0.581821 0.586128
Echinococcus multilocularis Phosphatidylinositol 4 kinase type 2 beta 0.0276112 0.825842 0.818783
Trypanosoma cruzi AMP deaminase, putative 0.0319347 0.975237 1
Trypanosoma cruzi adenosine kinase, putative 0.0161324 0.429199 0.440097
Toxoplasma gondii dipeptidyl peptidase iv (dpp iv) n-terminal region domain-containing protein 0.00562303 0.066053 0.0183994
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0064407 0.0943071 0.0489039
Giardia lamblia Glyceraldehyde 3-phosphate dehydrogenase 0.0127598 0.312661 1
Trypanosoma brucei AMP deaminase, putative 0.0319347 0.975237 1
Trypanosoma cruzi GMP synthase [glutamine-hydrolysing] 0.0059143 0.0761175 0.0780502
Brugia malayi Nucleoside transporter family protein 0.00483868 0.03895 0.039939
Loa Loa (eye worm) phosphatidylinositol 3 0.0276112 0.825842 0.842837
Echinococcus multilocularis concentrative Na+ nucleoside cotransporter 0.0326513 1 1
Trypanosoma cruzi glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 0.320599
Trichomonas vaginalis adenosine deaminase, putative 0.0113854 0.265169 0.838775
Loa Loa (eye worm) hypothetical protein 0.00512984 0.049011 0.0256158
Leishmania major adenosine monophosphate deaminase, putative,AMP deaminase, putative 0.0319347 0.975237 1
Trypanosoma brucei GMP synthase [glutamine-hydrolysing] 0.00703642 0.114892 0.071128
Trypanosoma cruzi AMP deaminase 2, putative 0.0113854 0.265169 0.271902
Echinococcus granulosus phosphatidylinositol 4 kinase beta 0.0064407 0.0943071 0.0576006
Giardia lamblia Phosphatidylinositol 4-kinase 0.0064407 0.0943071 0.202247
Trypanosoma brucei serine peptidase, Clan SC, Family S9B 0.00562303 0.066053 0.0183994
Toxoplasma gondii phosphatidylinositol 3- and 4-kinase 0.00535051 0.0566361 0.00823243
Toxoplasma gondii AMP deaminase 0.0319347 0.975237 1
Onchocerca volvulus 0.0113854 0.265169 0.241612
Trypanosoma brucei adenosine kinase, putative 0.0161324 0.429199 0.41047
Loa Loa (eye worm) phosphatidylinositol 3 0.0064407 0.0943071 0.073267
Brugia malayi adenosine monophosphate deaminase 0.0319347 0.975237 1
Echinococcus granulosus Phosphatidylinositol 4 kinase type 2 beta 0.0276112 0.825842 0.818783
Trypanosoma cruzi adenosine kinase, putative 0.0161324 0.429199 0.440097
Trypanosoma cruzi dipeptidyl-peptidase 8-like serine peptidase 0.00562303 0.066053 0.0677301
Giardia lamblia Glyceraldehyde 3-phosphate dehydrogenase 0.00794648 0.146338 0.392343
Loa Loa (eye worm) hypothetical protein 0.00703642 0.114892 0.0949219
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.00512984 0.049011 0.104968
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.00512984 0.049011 0.104968
Entamoeba histolytica glyceraldehyde-3-phosphate dehydrogenase, putative 0.0127598 0.312661 0.292336
Trichomonas vaginalis glyceraldehyde 3-phosphate dehydrogenase, putative 0.0127598 0.312661 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.00512984 0.049011 0.0107456
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.00512984 0.049011 0.0107456
Onchocerca volvulus 0.0146477 0.377896 0.36201

Activities

Activity type Activity value Assay description Source Reference
Activity (functional) = 97.2 % Antimalarial activity as reduced parasitaemia against Plasmodium berghei NK65 infected ICR mice (Mus musculus) at 20 mg/kg/day intraperitoneal dose at day 4 ChEMBL. 19181530
Activity (functional) = 99.8 % Antimalarial activity as reduced parasitaemia at day 4 against Plasmodium berghei NK65 infected ICR mice (Mus musculus) at 100 mg/kg/day peroral dose for 3 days ChEMBL. 19181530
IC50 (functional) = 0.005 uM Antiplasmodial activity against chloroquine and pyrimethamine-resistant Plasmodium falciparum K1 ChEMBL. 18476684
IC50 (functional) = 0.081 uM Antitrypanosomal activity against Trypanosoma cruzi Tulahuen C2C4 ChEMBL. 18476684
IC50 (functional) = 0.154 uM Antitrypanosomal activity against Trypanosoma brucei rhodesiense STIB900 ChEMBL. 18476684
IC50 (functional) = 1.136 uM Antileishmanial activity against Leishmania donovani MHOM-ET-67/L82 axenic amastigotes ChEMBL. 18476684
MSD (functional) = 11.3 day Antimalarial activity as mean survival days against Plasmodium berghei NK65 infected ICR mice (Mus musculus) at 100 mg/kg/day peroral dose at day 4 ChEMBL. 19181530
MSD (functional) = 16.8 day Antimalarial activity as mean survival days against Plasmodium berghei NK65 infected ICR mice (Mus musculus) at 20 mg/kg/day intraperitoneal dose ChEMBL. 19181530

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Trypanosoma cruzi ChEMBL23 18476684
Trypanosoma brucei gambiense 18476684
Leishmania donovani ChEMBL23 18476684
Plasmodium falciparum ChEMBL23 18476684

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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