Detailed information for compound 278730

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 333.208 | Formula: C13H20INO
  • H donors: 1 H acceptors: 1 LogP: 3.72 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN(Cc1cc(cc(c1O)I)C(C)(C)C)C
  • InChi: 1S/C13H20INO/c1-13(2,3)10-6-9(8-15(4)5)12(16)11(14)7-10/h6-7,16H,8H2,1-5H3
  • InChiKey: XCTGWUBSZMSEJY-UHFFFAOYSA-N  


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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 MH2 domain containing protein 0.0124 0.0373 0.0373
Giardia lamblia Neurogenic locus notch-like protein 0.0077 0.0171 0.9139
Mycobacterium ulcerans chorismate synthase 0.0795 0.3231 0.5904
Mycobacterium tuberculosis 3-phosphoshikimate 1-carboxyvinyltransferase AroA (5-enolpyruvylshikimate-3-phosphate synthase) (EPSP synthase) (EPSPS) 0.0132 0.0407 0.0697
Echinococcus granulosus integrin alpha ps 0.025 0.091 0.1235
Schistosoma mansoni caspase-7 (C14 family) 0.0095 0.0248 0.0425
Trypanosoma brucei protein kinase, putative 0.0081 0.0188 0.5469
Schistosoma mansoni amine oxidase 0.0092 0.0237 0.0408
Echinococcus granulosus beta LACTamase domain containing family member 0.0117 0.0343 0.0465
Entamoeba histolytica protein kinase, putative 0.0081 0.0188 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0142 0.0451 0.0612
Echinococcus multilocularis adam 0.0077 0.0171 0.0233
Loa Loa (eye worm) integrin alpha pat-2 0.1794 0.7487 0.7487
Echinococcus multilocularis cyclin dependent kinase 1 0.0037 0.0002 0.0002
Giardia lamblia Kinase, CMGC CDK 0.0037 0.0002 0.0091
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.034 0.129 0.2291
Loa Loa (eye worm) hypothetical protein 0.0124 0.0374 0.0374
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0116 0.034 0.0461
Schistosoma mansoni glycogen synthase kinase 3-related (gsk3) (cmgc group III) 0.0081 0.0188 0.0322
Echinococcus multilocularis integrin alpha 3 0.0892 0.3645 0.4947
Trichomonas vaginalis CMGC family protein kinase 0.0037 0.0002 0.005
Leishmania major hypothetical protein, conserved 0.0117 0.0343 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0748 0.3031 0.5969
Mycobacterium ulcerans lipase LipD 0.0117 0.0343 0.0526
Plasmodium falciparum glycogen synthase kinase 3 0.0081 0.0188 0.0575
Loa Loa (eye worm) hypothetical protein 0.0077 0.0171 0.0171
Echinococcus multilocularis glutamate receptor 2 0.0039 0.0008 0.0011
Schistosoma mansoni hypothetical protein 0.0095 0.0248 0.0425
Schistosoma mansoni serine/threonine protein kinase 0.0037 0.0002 0.0003
Brugia malayi EGF-like domain containing protein 0.0077 0.0171 0.0171
Echinococcus multilocularis integrin alpha ps 0.0522 0.2067 0.2805
Echinococcus multilocularis cyclin dependent kinase 0.0037 0.0002 0.0002
Plasmodium vivax hypothetical protein, conserved 0.0092 0.0237 0.073
Brugia malayi hypothetical protein 0.0095 0.0248 0.0248
Plasmodium vivax hypothetical protein, conserved 0.0092 0.0237 0.073
Trypanosoma cruzi cdc2-related kinase 3 0.0037 0.0002 0.005
Trichomonas vaginalis CMGC family protein kinase 0.0081 0.0188 0.5469
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.1311 0.543 1
Loa Loa (eye worm) hypothetical protein 0.0117 0.0343 0.0343
Mycobacterium tuberculosis Conserved hypothetical protein 0.0092 0.0237 0.0356
Echinococcus granulosus caspase 2 0.0095 0.0248 0.0336
Echinococcus multilocularis integrin alpha ps 0.025 0.091 0.1235
Schistosoma mansoni integrin alpha 0.1164 0.4802 0.8245
Schistosoma mansoni ATP-binding cassette transporter 0.0039 0.0008 0.0014
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0037 0.0002 0.0002
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0049 0.0052 0.007
Trichomonas vaginalis teneurin and N-acetylglucosamine-1-phosphodiester alpha-N-acetylglucosaminidase, putative 0.0077 0.0171 0.4999
Schistosoma mansoni inhibitor of apoptosis protein 0.0124 0.0374 0.0643
Loa Loa (eye worm) beta-lactamase 0.0117 0.0343 0.0343
Echinococcus multilocularis fibrillin 2 0.0077 0.0171 0.0233
Schistosoma mansoni hypothetical protein 0.025 0.091 0.1562
Mycobacterium ulcerans 3-dehydroquinate synthase 0.0132 0.0407 0.0646
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0207 0.0727 0.5
Mycobacterium ulcerans oxidoreductase 0.0092 0.0237 0.033
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0142 0.0451 0.0612
Toxoplasma gondii ABC1 family protein 0.0117 0.0343 0.1057
Trypanosoma cruzi cdc2-related kinase 1 0.0037 0.0002 0.005
Echinococcus granulosus baculoviral IAP repeat containing protein 0.0124 0.0374 0.0508
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0037 0.0002 0.0002
Echinococcus multilocularis beta LACTamase domain containing family member 0.0117 0.0343 0.0465
Plasmodium vivax hypothetical protein, conserved 0.0117 0.0343 0.1057
Echinococcus granulosus glutamate receptor 2 0.0049 0.0052 0.007
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0116 0.034 0.0461
Trichomonas vaginalis D-aminoacylase, putative 0.0117 0.0343 1
Giardia lamblia High cysteine protein 0.0077 0.0171 0.9139
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0117 0.0343 0.0589
Mycobacterium ulcerans esterase/lipase LipP 0.0117 0.0343 0.0526
Echinococcus granulosus glycogen synthase kinase 3 beta 0.0081 0.0188 0.0255
Schistosoma mansoni hypothetical protein 0.0373 0.1434 0.2462
Echinococcus granulosus lysine specific histone demethylase 1A 0.0092 0.0237 0.0322
Toxoplasma gondii histone lysine-specific demethylase 0.0092 0.0237 0.073
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0092 0.0237 0.033
Schistosoma mansoni glutamate receptor AMPA 0.0039 0.0008 0.0014
Schistosoma mansoni glutamate receptor kainate 0.0039 0.0008 0.0014
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0049 0.0052 0.007
Echinococcus multilocularis glutamate receptor 2 0.0049 0.0052 0.007
Mycobacterium tuberculosis Probable lipase LipD 0.0117 0.0343 0.0568
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0142 0.0451 0.0612
Giardia lamblia Tenascin-like 0.0077 0.0171 0.9139
Onchocerca volvulus 0.0095 0.0248 0.376
Giardia lamblia Tenascin-37 0.0077 0.0171 0.9139
Loa Loa (eye worm) hypothetical protein 0.0117 0.0343 0.0343
Echinococcus granulosus integrin alpha ps 0.0522 0.2067 0.2805
Entamoeba histolytica protein kinase domain containing protein 0.0081 0.0188 1
Trypanosoma cruzi cdc2-related kinase 1 0.0037 0.0002 0.005
Echinococcus granulosus nmda type glutamate receptor 0.0071 0.0145 0.0197
Loa Loa (eye worm) hypothetical protein 0.0092 0.0237 0.0237
Schistosoma mansoni inhibitor of apoptosis (iap) domain family member 0.0124 0.0374 0.0643
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0142 0.0451 0.0774
Trichomonas vaginalis penicillin-binding protein, putative 0.0117 0.0343 1
Trichomonas vaginalis CMGC family protein kinase 0.0037 0.0002 0.005
Echinococcus granulosus cyclin dependent kinase 5 0.0037 0.0002 0.0002
Mycobacterium ulcerans dehydrogenase 0.0092 0.0237 0.033
Brugia malayi Integrin alpha cytoplasmic region family protein 0.0881 0.3595 0.3595
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.034 0.129 0.8248
Brugia malayi Cell death protein 3 precursor 0.0095 0.0248 0.0248
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0117 0.0343 0.0343
Loa Loa (eye worm) glutamate receptor 1 0.0039 0.0008 0.0008
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0142 0.0451 0.0451
Giardia lamblia Neurogenic locus Notch protein precursor 0.0077 0.0171 0.9139
Echinococcus multilocularis protoporphyrinogen oxidase 0.0092 0.0237 0.0322
Loa Loa (eye worm) hypothetical protein 0.0914 0.3737 0.3737
Giardia lamblia Kinase, CMGC GSK 0.0081 0.0188 1
Schistosoma mansoni integrin alpha-ps 0.0272 0.1001 0.1719
Plasmodium vivax chorismate synthase 0.0795 0.3231 1
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.1723 0.7182 0.9748
Onchocerca volvulus 0.0081 0.0188 0.0795
Echinococcus multilocularis glycogen synthase kinase 3 beta 0.0081 0.0188 0.0255
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0142 0.0451 0.0774
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0116 0.034 0.052
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0071 0.0145 0.0197
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0116 0.034 0.052
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0081 0.0188 0.0188
Echinococcus multilocularis caspase 2 0.0095 0.0248 0.0336
Mycobacterium leprae conserved hypothetical protein 0.0117 0.0343 0.0826
Giardia lamblia Tenascin precursor 0.0077 0.0171 0.9139
Echinococcus multilocularis cyclin dependent kinase 5 0.0037 0.0002 0.0002
Giardia lamblia Tenascin-X 0.0077 0.0171 0.9139
Trichomonas vaginalis D-aminoacylase, putative 0.0117 0.0343 1
Giardia lamblia Kinase, CMGC CDK 0.0037 0.0002 0.0091
Loa Loa (eye worm) hypothetical protein 0.0117 0.0343 0.0343
Schistosoma mansoni hypothetical protein 0.0124 0.0374 0.0643
Giardia lamblia hypothetical protein 0.0077 0.0171 0.9139
Loa Loa (eye worm) kelch domain-containing protein family protein 0.0362 0.1387 0.1387
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0117 0.0343 0.0568
Trichomonas vaginalis penicillin-binding protein, putative 0.0117 0.0343 1
Trichomonas vaginalis hypothetical protein 0.0077 0.0171 0.4999
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0241 0.087 0.087
Brugia malayi beta-lactamase family protein 0.0117 0.0343 0.0343
Brugia malayi Glutamate receptor 1 precursor 0.0039 0.0008 0.0008
Toxoplasma gondii hypothetical protein 0.0077 0.0171 0.0526
Chlamydia trachomatis phosphoshikimate 1-carboxyl vinyltransferase 0.034 0.129 0.388
Trypanosoma cruzi UDP-galactopyranose mutase 0.0092 0.0237 0.6926
Brugia malayi hypothetical protein 0.0092 0.0237 0.0237
Echinococcus multilocularis cyclin dependent kinase 1 0.0037 0.0002 0.0002
Loa Loa (eye worm) hypothetical protein 0.0117 0.0343 0.0343
Loa Loa (eye worm) hypothetical protein 0.0092 0.0237 0.0237
Toxoplasma gondii cell-cycle-associated protein kinase GSK, putative 0.0081 0.0188 0.0575
Loa Loa (eye worm) hypothetical protein 0.0881 0.3595 0.3595
Trichomonas vaginalis esterase, putative 0.0117 0.0343 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.0237 0.0237
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0116 0.034 0.9912
Loa Loa (eye worm) hypothetical protein 0.0095 0.0248 0.0248
Brugia malayi EGF-like domain containing protein 0.0077 0.0171 0.0171
Echinococcus multilocularis apoptotic protease activating factor 1 0.0095 0.0248 0.0336
Brugia malayi follicle stimulating hormone receptor 0.0241 0.087 0.087
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0037 0.0002 0.0002
Plasmodium vivax lysine-specific histone demethylase 1, putative 0.0092 0.0237 0.073
Plasmodium vivax glycogen synthase kinase 3, putative 0.0081 0.0188 0.0575
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.1311 0.543 1
Toxoplasma gondii chorismate synthase, putative 0.0795 0.3231 1
Loa Loa (eye worm) glutamate receptor 2 0.0039 0.0008 0.0008
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0142 0.0451 0.0774
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0092 0.0237 0.0408
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.1219 0.5037 1
Echinococcus multilocularis baculoviral IAP repeat containing protein 0.0124 0.0374 0.0508
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0142 0.0451 0.0451
Echinococcus multilocularis protein kinase shaggy 0.0081 0.0188 0.0255
Mycobacterium tuberculosis Possible oxidoreductase 0.0092 0.0237 0.0356
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.0373 0.0373
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0049 0.0052 0.007
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0117 0.0343 0.0589
Loa Loa (eye worm) hypothetical protein 0.025 0.091 0.091
Echinococcus granulosus glutamate NMDA receptor subunit 0.0039 0.0008 0.0011
Brugia malayi intracellular kinase 0.0081 0.0188 0.0188
Echinococcus granulosus fibrillin 1 0.0077 0.0171 0.0233
Chlamydia trachomatis UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0207 0.0727 0.2104
Echinococcus multilocularis integrin alpha ps 0.0522 0.2067 0.2805
Trypanosoma brucei cdc2-related kinase 3 0.0037 0.0002 0.005
Plasmodium falciparum protoporphyrinogen oxidase 0.0092 0.0237 0.073
Schistosoma mansoni glutamate receptor kainate 0.0039 0.0008 0.0014
Entamoeba histolytica cell division protein kinase 2, putative 0.0037 0.0002 0.0091
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0207 0.0727 1
Echinococcus granulosus geminin 0.0373 0.1434 0.1947
Mycobacterium tuberculosis Conserved protein 0.0117 0.0343 0.0568
Echinococcus granulosus integrin beta 2 0.1766 0.7368 1
Brugia malayi EGF-like domain containing protein 0.0077 0.0171 0.0171
Mycobacterium tuberculosis Probable esterase LipL 0.0117 0.0343 0.0568
Loa Loa (eye worm) hypothetical protein 0.0077 0.0171 0.0171
Schistosoma mansoni glutamate receptor AMPA 0.0039 0.0008 0.0014
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0117 0.0343 0.0343
Mycobacterium leprae 3-dehydroquinate synthase AroB 0.0132 0.0407 0.1328
Loa Loa (eye worm) hypothetical protein 0.0272 0.1001 0.1001
Loa Loa (eye worm) hypothetical protein 0.0124 0.0374 0.0374
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0039 0.0008 0.0011
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0049 0.0052 0.007
Entamoeba histolytica protein kinase domain containing protein 0.0081 0.0188 1
Echinococcus granulosus apoptotic protease activating factor 1 0.0095 0.0248 0.0336
Mycobacterium tuberculosis Conserved protein 0.0117 0.0343 0.0568
Trichomonas vaginalis D-aminoacylase, putative 0.0117 0.0343 1
Onchocerca volvulus 0.0117 0.0343 0.8451
Trypanosoma cruzi cdc2-related kinase 3 0.0037 0.0002 0.005
Echinococcus multilocularis fibrillin 1 0.0077 0.0171 0.0233
Brugia malayi Kelch motif family protein 0.0362 0.1387 0.1387
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0049 0.0052 0.007
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.034 0.129 0.3991
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0109 0.0306 0.0306
Chlamydia trachomatis dehyroquinate synthase 0.0132 0.0407 0.1093
Plasmodium vivax protoporphyrinogen oxidase, putative 0.0092 0.0237 0.073
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0092 0.0237 0.073
Trypanosoma brucei cdc2-related kinase 1 0.0037 0.0002 0.005
Schistosoma mansoni glutamate receptor NMDA 0.0049 0.0052 0.0089
Loa Loa (eye worm) hypothetical protein 0.0095 0.0248 0.0248
Onchocerca volvulus 0.0124 0.0374 1
Trypanosoma cruzi UDP-galactopyranose mutase 0.0092 0.0237 0.6926
Brugia malayi Glutamate receptor 2 precursor 0.0039 0.0008 0.0008
Onchocerca volvulus Cell death protein 3 homolog 0.0095 0.0248 0.376
Loa Loa (eye worm) hypothetical protein 0.0092 0.0237 0.0237
Entamoeba histolytica cell division protein kinase 2, putative 0.0037 0.0002 0.0091
Mycobacterium tuberculosis Probable hydrolase 0.0117 0.0343 0.0568
Loa Loa (eye worm) hypothetical protein 0.0117 0.0343 0.0343
Loa Loa (eye worm) hypothetical protein 0.0117 0.0343 0.0343
Echinococcus granulosus protein kinase shaggy 0.0081 0.0188 0.0255
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0116 0.034 0.0562
Onchocerca volvulus Deterin homolog 0.0124 0.0374 1
Schistosoma mansoni integrin beta subunit 0.1404 0.5824 1
Echinococcus granulosus fibrillin 2 0.0077 0.0171 0.0233
Giardia lamblia Kinase, CMGC GSK 0.0081 0.0188 1
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.0207 0.0727 0.1242
Echinococcus granulosus integrin alpha 3 0.0892 0.3645 0.4947
Schistosoma mansoni amine oxidase 0.0092 0.0237 0.0408
Echinococcus multilocularis inhibitor of apoptosis protein 0.0124 0.0374 0.0508
Loa Loa (eye worm) CMGC/GSK protein kinase 0.0081 0.0188 0.0188
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0092 0.0237 0.073
Brugia malayi Integrin alpha pat-2 precursor 0.1164 0.4802 0.4802
Mycobacterium tuberculosis Probable chorismate synthase AroF (5-enolpyruvylshikimate-3-phosphate phospholyase) 0.0392 0.1514 0.2921
Giardia lamblia High cysteine protein 0.0077 0.0171 0.9139
Loa Loa (eye worm) hypothetical protein 0.0642 0.258 0.258
Plasmodium falciparum lysine-specific histone demethylase 1, putative 0.0092 0.0237 0.073
Brugia malayi SWIRM domain containing protein 0.0092 0.0237 0.0237
Loa Loa (eye worm) hypothetical protein 0.0092 0.0237 0.0237
Mycobacterium tuberculosis 3-dehydroquinate synthase AroB 0.0132 0.0407 0.0697
Echinococcus multilocularis integrin beta 2 0.1766 0.7368 1
Echinococcus multilocularis 0.0092 0.0237 0.0322
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0117 0.0343 0.0568
Onchocerca volvulus 0.0117 0.0343 0.8451
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0037 0.0002 0.0002
Leishmania major UDP-galactopyranose mutase 0.0092 0.0237 0.6926
Onchocerca volvulus 0.0092 0.0237 0.3256
Loa Loa (eye worm) hypothetical protein 0.0092 0.0237 0.0237
Chlamydia trachomatis protoporphyrinogen oxidase 0.0092 0.0237 0.0558
Mycobacterium leprae Chorismate synthase AroF (5-enolpyruvylshikimate-3-phosphate phospholyase). 0.0392 0.1514 1
Trypanosoma cruzi hypothetical protein, conserved 0.0117 0.0343 1
Mycobacterium tuberculosis Probable lipase LipE 0.0117 0.0343 0.0568
Brugia malayi beta-lactamase 0.0117 0.0343 0.0343
Schistosoma mansoni serine/threonine protein kinase 0.0037 0.0002 0.0003
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0124 0.0374 0.0374
Echinococcus granulosus cyclin dependent kinase 1 0.0037 0.0002 0.0002
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.0373 0.0373
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0142 0.0451 0.0612
Brugia malayi Inhibitor of Apoptosis domain containing protein 0.0124 0.0374 0.0374
Echinococcus granulosus cyclin dependent kinase 0.0037 0.0002 0.0002
Trypanosoma cruzi hypothetical protein, conserved 0.0117 0.0343 1
Echinococcus multilocularis geminin 0.0373 0.1434 0.1947
Brugia malayi hypothetical protein 0.0362 0.1387 0.1387
Brugia malayi EGF-like domain containing protein 0.0077 0.0171 0.0171
Mycobacterium ulcerans hypothetical protein 0.0117 0.0343 0.0526
Echinococcus granulosus adam 0.0077 0.0171 0.0233
Schistosoma mansoni 3-dehydroquinate synthase 0.0132 0.0407 0.0699
Trichomonas vaginalis CMGC family protein kinase 0.0037 0.0002 0.005
Echinococcus granulosus inhibitor of apoptosis protein 0.0124 0.0374 0.0508
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0116 0.034 0.034
Mycobacterium ulcerans monoamine oxidase 0.0092 0.0237 0.033
Onchocerca volvulus 0.0117 0.0343 0.8451
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0049 0.0052 0.007
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0092 0.0237 0.0322
Loa Loa (eye worm) hypothetical protein 0.0362 0.1387 0.1387
Mycobacterium tuberculosis Conserved protein 0.0117 0.0343 0.0568
Brugia malayi amine oxidase, flavin-containing family protein 0.0092 0.0237 0.0237
Schistosoma mansoni glutamate receptor NMDA 0.0039 0.0008 0.0014
Schistosoma mansoni integrin alpha-ps 0.0522 0.2067 0.3549
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0092 0.0237 0.0408
Schistosoma mansoni glutamate receptor kainate 0.0039 0.0008 0.0014
Echinococcus multilocularis protein jagged 2 0.0077 0.0171 0.0233
Chlamydia trachomatis chorismate synthase 0.0795 0.3231 1
Echinococcus multilocularis nmda type glutamate receptor 0.0071 0.0145 0.0197
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0049 0.0052 0.007
Trypanosoma brucei hypothetical protein, conserved 0.0117 0.0343 1
Loa Loa (eye worm) integrin beta-2 0.2384 1 1
Trypanosoma cruzi glycogen synthase kinase 3, putative 0.0081 0.0188 0.5469
Loa Loa (eye worm) hypothetical protein 0.0077 0.0171 0.0171
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0116 0.034 0.0584
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0049 0.0052 0.007
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0037 0.0002 0.005
Echinococcus granulosus lysine specific histone demethylase 1A 0.0092 0.0237 0.0322
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0117 0.0343 0.0526
Brugia malayi cell division control protein 2 homolog 0.0037 0.0002 0.0002
Mycobacterium leprae Probable lipase LipE 0.0117 0.0343 0.0826
Brugia malayi Protein kinase domain containing protein 0.0037 0.0002 0.0002
Trichomonas vaginalis CMGC family protein kinase 0.0081 0.0188 0.5469
Loa Loa (eye worm) hypothetical protein 0.0077 0.0171 0.0171
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0037 0.0002 0.005
Plasmodium falciparum chorismate synthase 0.0795 0.3231 1
Leishmania major glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270 0.0081 0.0188 0.5469
Mycobacterium ulcerans beta-lactamase 0.0117 0.0343 0.0526
Brugia malayi beta-lactamase family protein 0.0117 0.0343 0.0343
Schistosoma mansoni hypothetical protein 0.0373 0.1434 0.2462
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0117 0.0343 0.0568

Activities

Activity type Activity value Assay description Source Reference
Saluretic potency (ADMET) = 1.4 u equiv Saluretic property was estimated by the excretion of Na+ in rat administered orally; microequiv of Na+ at 5 mg/kg iv stat ChEMBL. 7097728
Saluretic potency (ADMET) = 2.7 u equiv Saluretic property was estimated by the excretion of Na+ in rat administered orally; microequiv of Na+ at 16.5 mg/kg iv stat ChEMBL. 7097728
Saluretic potency (ADMET) = 3.3 u equiv Saluretic property (excretion of Na+ in rat after PO dosing) ChEMBL. 7097728
Saluretic potency (ADMET) = 0 u equiv min-1 Saluretic property was estimated by the excretion of Na+ in dog administered intravenously; microequiv of Na+/min at 5 mg/kg iv stat, 0-99 ChEMBL. 7097728

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

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.