Detailed information for compound 918173

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 217.305 | Formula: C11H23NO3
  • H donors: 4 H acceptors: 3 LogP: 0.92 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCC[C@@H]1N[C@H](CO)[C@@H]([C@@H]([C@H]1C)O)O
  • InChi: 1S/C11H23NO3/c1-3-4-5-8-7(2)10(14)11(15)9(6-13)12-8/h7-15H,3-6H2,1-2H3/t7-,8-,9+,10+,11-/m0/s1
  • InChiKey: CAVTXTZKYKUABF-DAWVFNFOSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Coffea arabica Alpha-galactosidase Starlite/ChEMBL References
Homo sapiens galactosidase, alpha Starlite/ChEMBL References
Oryza sativa Os06g0675700 Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Toxoplasma gondii melibiase subfamily protein Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma japonicum Alpha-N-acetylgalactosaminidase, putative Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma japonicum Lysosomal alpha-glucosidase precursor, putative Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase Get druggable targets OG5_127620 All targets in OG5_127620
Echinococcus multilocularis Glycoside hydrolase, family 27 Get druggable targets OG5_127620 All targets in OG5_127620
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Alpha-N-acetylgalactosaminidase, putative Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma japonicum expressed protein Get druggable targets OG5_127620 All targets in OG5_127620
Echinococcus granulosus Alpha N acetylgalactosaminidase Get druggable targets OG5_127620 All targets in OG5_127620
Onchocerca volvulus Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans cell wall mannoprotein glycosyl hydrolase whose expression increases in presence of galatose Get druggable targets OG5_127055 All targets in OG5_127055
Brugia malayi Melibiase family protein Get druggable targets OG5_127620 All targets in OG5_127620
Loa Loa (eye worm) glycosyl hydrolase family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma japonicum ko:K01187 alpha-glucosidase [EC3.2.1.20], putative Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus multilocularis Alpha N acetylgalactosaminidase Get druggable targets OG5_127620 All targets in OG5_127620
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127620 All targets in OG5_127620
Brugia malayi Glycosyl hydrolases family 31 protein Get druggable targets OG5_127055 All targets in OG5_127055
Echinococcus granulosus lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Alpha-N-acetylgalactosaminidase precursor, putative Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans hypothetical protein Get druggable targets OG5_127055 All targets in OG5_127055
Candida albicans closely related to C. albicans GCA1 cell wall mannoprotein glycosyl hydrolase Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma japonicum Alpha-N-acetylgalactosaminidase, putative Get druggable targets OG5_127620 All targets in OG5_127620
Echinococcus multilocularis lysosomal alpha glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Neospora caninum hypothetical protein Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma japonicum ko:K01204 alpha-N-acetylgalactosaminidase [EC3.2.1.49], putative Get druggable targets OG5_127620 All targets in OG5_127620
Schistosoma mansoni alpha-glucosidase Get druggable targets OG5_127055 All targets in OG5_127055
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase Get druggable targets OG5_127620 All targets in OG5_127620
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Neospora caninum alpha-galactosidase A, putative Alpha-galactosidase   378 aa 346 aa 26.9 %
Onchocerca volvulus Alpha-galactosidase   378 aa 363 aa 39.1 %
Toxoplasma gondii Alpha-galactosidase Alpha-galactosidase   378 aa 363 aa 29.2 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni hypothetical protein 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0189 0.1559
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.018 0.1016 0.4873
Onchocerca volvulus Glucosylceramidase homolog 0.0205 0.1211 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0055 0.0025 0.0025
Leishmania major fk506-binding protein 1-like protein 0.0106 0.0432 0.2494
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus multilocularis tissue type plasminogen activator 0.0062 0.0087 0.0474
Schistosoma mansoni hypothetical protein 0.0072 0.0164 0.1054
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2059 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus granulosus neuropeptide s receptor 0.0075 0.0189 0.1245
Schistosoma mansoni neuropeptide receptor 0.0075 0.0189 0.1245
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59 0.0106 0.0432 0.2099
Loa Loa (eye worm) neuropeptide F receptor 0.0075 0.0189 0.0189
Echinococcus multilocularis neuropeptide Y receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis serotonin receptor 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0189 0.1559
Leishmania major peptidylprolyl isomerase-like protein 0.0106 0.0432 0.2494
Schistosoma mansoni tfiia large subunit 0.0106 0.0435 0.3116
Brugia malayi G-protein coupled receptor 0.0075 0.0189 0.0917
Echinococcus granulosus serotonin receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) FKBP-type peptidyl-prolyl cis-trans isomerase-12 0.0106 0.0432 0.0432
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2059 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0069 0.0136 0.0843
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni neuropeptide receptor 0.0075 0.0189 0.1245
Echinococcus granulosus g protein coupled receptor 0.0075 0.0189 0.1245
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0075 0.0189 0.1245
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0075 0.0189 0.1559
Onchocerca volvulus 0.0076 0.0194 0.1602
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0075 0.0189 0.1245
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1211 0.5832
Echinococcus granulosus tissue type plasminogen activator 0.0062 0.0087 0.0474
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus granulosus neuropeptides capa receptor 0.0075 0.0189 0.1245
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0075 0.0189 0.1245
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1211 0.5832
Echinococcus multilocularis rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Loa Loa (eye worm) TYRA-2 protein 0.0075 0.0189 0.0189
Brugia malayi Serotonin receptor 0.0075 0.0189 0.0917
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1211 0.5832
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0075 0.0189 0.1245
Brugia malayi GnHR receptor homolog 0.0075 0.0189 0.0917
Schistosoma mansoni alpha-1 adrenergic receptor 0.0075 0.0189 0.1245
Brugia malayi G-protein coupled receptor 0.0075 0.0189 0.0917
Echinococcus multilocularis neuropeptide FF receptor 2 0.0075 0.0189 0.1245
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Schistosoma mansoni neuropeptide receptor 0.0075 0.0189 0.1245
Echinococcus granulosus orexin receptor type 2 0.0075 0.0189 0.1245
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0075 0.0189 0.1245
Echinococcus granulosus neuropeptide FF receptor 2 0.0075 0.0189 0.1245
Loa Loa (eye worm) transcription factor IIA 0.0106 0.0435 0.0435
Echinococcus multilocularis Mastin 0.0069 0.0136 0.0843
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0106 0.0432 0.2002
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Onchocerca volvulus 0.0053 0.0016 0.0128
Echinococcus multilocularis glycoprotein Antigen 5 0.0069 0.0136 0.0843
Schistosoma mansoni hypothetical protein 0.0075 0.0189 0.1245
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0075 0.0189 0.1245
Echinococcus granulosus biogenic amine 5HT receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0178 0.1003 0.1003
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1298 0.626
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis g protein coupled receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Echinococcus granulosus rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Mycobacterium tuberculosis Conserved hypothetical protein 0.0138 0.0681 0.5
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0106 0.0432 0.2494
Plasmodium falciparum peptidyl-prolyl cis-trans isomerase FKBP35 0.0106 0.0432 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0075 0.0189 0.1245
Echinococcus granulosus alpha 1A adrenergic receptor 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0189 0.1559
Loa Loa (eye worm) hypothetical protein 0.0076 0.0194 0.0194
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.0075 0.0189 0.1245
Echinococcus granulosus hypothetical protein 0.0075 0.0189 0.1245
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1211 0.5832
Echinococcus multilocularis fk506 binding protein 0.0106 0.0432 0.3093
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni neuropeptide f receptor 76f 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0062 0.0087 0.0087
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus multilocularis fmrfamide receptor 0.0075 0.0189 0.1245
Plasmodium vivax 70 kDa peptidylprolyl isomerase, putative 0.0106 0.0432 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni alpha-glucosidase 0.0144 0.0733 0.5376
Echinococcus multilocularis tfiia large subunit 0.0106 0.0435 0.3116
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Brugia malayi RE15519p 0.0075 0.0189 0.0917
Echinococcus granulosus tfiia large subunit 0.0106 0.0435 0.3116
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2059 1
Echinococcus multilocularis neuropeptide receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni amine GPCR 0.0075 0.0189 0.1245
Echinococcus multilocularis rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type , putative 0.0106 0.0432 1
Echinococcus multilocularis neuropeptide receptor A26 0.0075 0.0189 0.1245
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni amine GPCR 0.0075 0.0189 0.1245
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0221 0.1342 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0125 0.0584 0.4247
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0075 0.0189 0.0917
Brugia malayi latrophilin 2 splice variant baaae 0.0072 0.0164 0.0795
Leishmania major hypothetical protein, conserved 0.0062 0.0087 0.0382
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.0075 0.0189 0.1245
Toxoplasma gondii PAN domain-containing protein 0.0595 0.4298 1
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0075 0.0189 0.1245
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2059 1
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Schistosoma mansoni myosin xvIII 0.0075 0.0189 0.1245
Schistosoma mansoni immunophilin 0.0106 0.0432 0.3093
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Echinococcus granulosus neuropeptides capa receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) FKBP5 protein 0.0106 0.0432 0.0432
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0075 0.0189 0.1245
Echinococcus multilocularis neuropeptide Y receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis neuropeptide s receptor 0.0075 0.0189 0.1245
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.018 0.1016 0.7526
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Onchocerca volvulus 0.0075 0.0189 0.1559
Onchocerca volvulus Neuropeptide F receptor homolog 0.0075 0.0189 0.1559
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0124 0.057 0.3341
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni biogenic amine receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0124 0.057 0.3341
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0189 0.1559
Trichomonas vaginalis glucosylceramidase, putative 0.0216 0.1298 0.626
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0106 0.0432 0.3093
Schistosoma mansoni hypothetical protein 0.0075 0.0189 0.1245
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0221 0.1342 1
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0075 0.0189 0.0189
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0075 0.0189 0.0189
Brugia malayi Melibiase family protein 0.018 0.1016 0.4935
Echinococcus granulosus histone acetyltransferase KAT2B 0.0122 0.0556 0.4036
Schistosoma mansoni biogenic amine (5HT) receptor 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0189 0.1559
Schistosoma mansoni growth hormone secretagogue receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.1317 1 1
Onchocerca volvulus 0.0075 0.0189 0.1559
Echinococcus granulosus biogenic amine 5HT receptor 0.0075 0.0189 0.1245
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Echinococcus granulosus enteropeptidase 0.0069 0.0136 0.0843
Echinococcus granulosus rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus granulosus rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0221 0.1342 1
Echinococcus granulosus sex peptide receptor 0.0075 0.0189 0.1245
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus granulosus dro:myosuppressin receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0189 0.1559
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0075 0.0189 0.0917
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0075 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Brugia malayi G protein-coupled receptor F59B2.13 0.0075 0.0189 0.0917
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0221 0.1342 1
Echinococcus multilocularis neuropeptides capa receptor 0.0075 0.0189 0.1245
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0106 0.0432 0.2494
Echinococcus multilocularis g-protein coupled receptor 0.0075 0.0189 0.1245
Trypanosoma cruzi FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0106 0.0432 0.2494
Schistosoma mansoni biogenic amine receptor 0.0075 0.0189 0.1245
Brugia malayi Serotonin receptor 0.0075 0.0189 0.0917
Echinococcus granulosus g-protein coupled receptor 0.0075 0.0189 0.1245
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase, putative 0.0106 0.0432 0.2494
Onchocerca volvulus 0.0075 0.0189 0.1559
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Toxoplasma gondii melibiase subfamily protein 0.0221 0.1342 0.3121
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.0075 0.0189 0.1245
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1211 0.5832
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0261 0.1657 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Loa Loa (eye worm) G-protein coupled receptor 0.0075 0.0189 0.0189
Schistosoma mansoni opsin-like receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0075 0.0189 0.1245
Schistosoma mansoni hypothetical protein 0.0075 0.0189 0.1245
Toxoplasma gondii kringle domain-containing protein 0.0062 0.0087 0.0203
Echinococcus granulosus tm gpcr rhodopsin 0.0075 0.0189 0.1245
Echinococcus granulosus G protein coupled receptor 139 0.0075 0.0189 0.1245
Echinococcus multilocularis rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0072 0.0164 0.0164
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2059 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0221 0.1342 1
Echinococcus granulosus allatostatin A receptor 0.0075 0.0189 0.1245
Schistosoma mansoni amine GPCR 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0189 0.1559
Schistosoma mansoni amine GPCR 0.0075 0.0189 0.1245
Echinococcus multilocularis sex peptide receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0091 0.0317 0.0317
Schistosoma mansoni histamine h1 receptor 0.0075 0.0189 0.1245
Schistosoma mansoni tfiia large subunit 0.0106 0.0435 0.3116
Trichomonas vaginalis immunophilin, putative 0.0106 0.0432 0.2002
Brugia malayi acetyltransferase, GNAT family protein 0.0125 0.0584 0.2837
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus multilocularis G-protein coupled receptor, putative 0.0075 0.0189 0.1245
Leishmania major mitochondrial DNA polymerase beta 0.0261 0.1657 1
Echinococcus granulosus tachykinin peptides receptor 99D 0.0075 0.0189 0.1245
Echinococcus granulosus fmrfamide receptor 0.0075 0.0189 0.1245
Echinococcus granulosus g protein coupled receptor 0.0075 0.0189 0.1245
Mycobacterium ulcerans hypothetical protein 0.0138 0.0681 1
Echinococcus multilocularis enteropeptidase 0.0069 0.0136 0.0843
Echinococcus multilocularis neuropeptides capa receptor 0.0075 0.0189 0.1245
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.018 0.1016 0.7526
Echinococcus multilocularis neuropeptide receptor 0.0075 0.0189 0.1245
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0075 0.0189 0.1245
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.0075 0.0189 0.1245
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Echinococcus granulosus somatostatin receptor 0.0075 0.0189 0.1245
Echinococcus granulosus neuropeptide Y receptor 0.0075 0.0189 0.1245
Schistosoma mansoni hypothetical protein 0.0062 0.0087 0.0474
Onchocerca volvulus 0.0075 0.0189 0.1559
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Brugia malayi Dopamine receptor protein 2 0.0075 0.0189 0.0917
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0106 0.0427 0.0427
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0261 0.1657 1
Echinococcus granulosus neuropeptide receptor 0.0075 0.0189 0.1245
Schistosoma mansoni immunophilin 0.0091 0.0317 0.2216
Echinococcus multilocularis rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Brugia malayi neuropeptide F receptor 0.0075 0.0189 0.0917
Toxoplasma gondii PAN domain-containing protein 0.0595 0.4298 1
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0075 0.0189 0.0917
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni neuropeptide F-like receptor 0.0075 0.0189 0.1245
Treponema pallidum peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB) 0.0106 0.0432 0.5
Onchocerca volvulus 0.0075 0.0189 0.1559
Loa Loa (eye worm) acetyltransferase 0.0125 0.0584 0.0584
Echinococcus multilocularis orexin receptor type 2 0.0075 0.0189 0.1245
Echinococcus granulosus rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Echinococcus granulosus neuropeptide receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis peptidyl prolyl cis trans isomerase FKBP4 0.0091 0.0317 0.2216
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0075 0.0189 0.0917
Brugia malayi Melatonin receptor type 1A 0.0075 0.0189 0.0917
Echinococcus multilocularis dro:myosuppressin receptor 0.0075 0.0189 0.1245
Trichomonas vaginalis glucosylceramidase, putative 0.0312 0.2059 1
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase, putative 0.0106 0.0432 0.2494
Loa Loa (eye worm) G-protein coupled receptor 0.0075 0.0189 0.0189
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0075 0.0189 0.0189
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0075 0.0189 0.1245
Echinococcus granulosus peptide allatostatin:somatostatin 0.0075 0.0189 0.1245
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0106 0.0432 0.3093
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Brugia malayi sulfakinin receptor protein 0.0075 0.0189 0.0917
Echinococcus multilocularis allatostatin A receptor 0.0075 0.0189 0.1245
Echinococcus granulosus neuropeptide Y receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Brugia malayi Trypsin family protein 0.0076 0.0194 0.0942
Echinococcus granulosus 7tm_1 domain containing protein 0.0075 0.0189 0.1245
Echinococcus multilocularis fmrfamide receptor 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0189 0.1559
Brugia malayi Tachykinin-like peptides receptor 99D 0.0075 0.0189 0.0917
Loa Loa (eye worm) hypothetical protein 0.0053 0.0009 0.0009
Onchocerca volvulus 0.0062 0.0087 0.072
Onchocerca volvulus 0.0075 0.0189 0.1559
Giardia lamblia FKBP-type peptidyl-prolyl cis-trans isomerase 0.0106 0.0432 0.5
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0221 0.1342 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni adenoreceptor 0.0075 0.0189 0.1245
Schistosoma mansoni opsin-like receptor 0.0075 0.0189 0.1245
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP4 0.0091 0.0317 0.2216
Echinococcus multilocularis lysosomal alpha glucosidase 0.0178 0.1003 0.7431
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1211 0.5832
Schistosoma mansoni immunophilin 0.0106 0.0432 0.3093
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis somatostatin receptor 0.0075 0.0189 0.1245
Echinococcus granulosus rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Onchocerca volvulus 0.0075 0.0184 0.1517
Echinococcus multilocularis g protein coupled receptor 0.0075 0.0189 0.1245
Echinococcus granulosus 7TM GPCR rhodopsin 0.0075 0.0189 0.1245
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus multilocularis rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0221 0.1342 1
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, FKBP-type, putative 0.0106 0.0432 1
Loa Loa (eye worm) melatonin receptor type 1A 0.0075 0.0189 0.0189
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0312 0.2059 0.2059
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Onchocerca volvulus 0.0075 0.0189 0.1559
Brugia malayi larval opioid receptor 0.0075 0.0189 0.0917
Echinococcus granulosus g protein coupled receptor 0.0075 0.0189 0.1245
Echinococcus granulosus Mastin 0.0069 0.0136 0.0843
Brugia malayi G protein-coupled receptor 0.0075 0.0189 0.0917
Brugia malayi putative neuropeptide receptor NPR1 0.0075 0.0189 0.0917
Brugia malayi FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12 0.0106 0.0432 0.2099
Brugia malayi Glycosyl hydrolases family 31 protein 0.0055 0.0025 0.0121
Echinococcus granulosus rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0075 0.0189 0.0189
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0075 0.0189 0.1245
Brugia malayi Dopamine receptor protein 1 0.0075 0.0189 0.0917
Brugia malayi Calcitonin receptor-like protein seb-1 0.0106 0.0427 0.2077
Schistosoma mansoni biogenic amine (5HT) receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0076 0.0194 0.0194
Schistosoma mansoni immunophilin FK506 binding protein FKBP12 0.0106 0.0432 0.3093
Brugia malayi ORL1-like opioid receptor 0.0075 0.0189 0.0917
Loa Loa (eye worm) neuropeptide F receptor 0.0075 0.0189 0.0189
Echinococcus granulosus tm gpcr rhodopsin 0.0075 0.0189 0.1245
Brugia malayi Glycosyl hydrolases family 31 protein 0.0178 0.1003 0.4874
Trypanosoma cruzi hypothetical protein, conserved 0.0062 0.0087 0.0382
Brugia malayi Dopamine receptor 0.0075 0.0189 0.0917
Echinococcus granulosus tfiia large subunit 0.0106 0.0435 0.3116
Brugia malayi hypothetical protein 0.0075 0.0189 0.0917
Brugia malayi Muscle positioning protein 4 0.0053 0.0016 0.0075
Loa Loa (eye worm) TK/ROR protein kinase 0.0062 0.0087 0.0087
Echinococcus multilocularis tfiia large subunit 0.0106 0.0435 0.3116
Brugia malayi AKH receptor 0.0075 0.0189 0.0917
Echinococcus multilocularis rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Echinococcus granulosus neuropeptide receptor A26 0.0075 0.0189 0.1245
Trypanosoma brucei FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative 0.0106 0.0432 0.2494
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0124 0.057 0.3341
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Giardia lamblia 70 kDa peptidylprolyl isomerase, putative 0.0106 0.0432 0.5
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0312 0.2059 1
Echinococcus granulosus glycoprotein Antigen 5 0.0069 0.0136 0.0843
Schistosoma mansoni biogenic amine receptor 0.0075 0.0189 0.1245
Trichomonas vaginalis peptidylprolyl isomerase, putative 0.0106 0.0432 0.2002
Loa Loa (eye worm) hypothetical protein 0.0106 0.0427 0.0427
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0125 0.0584 0.4247
Echinococcus granulosus peptidyl prolyl cis trans isomerase FKBP1A 0.0106 0.0432 0.3093
Brugia malayi follicle stimulating hormone receptor 0.0075 0.0189 0.0917
Schistosoma mansoni rhodopsin-like orphan GPCR 0.0075 0.0189 0.1245
Echinococcus granulosus rhodopsin orphan GPCR 0.0075 0.0189 0.1245
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0055 0.0025 0.0058
Echinococcus multilocularis serotonin receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus multilocularis g protein coupled receptor 0.0075 0.0189 0.1245
Schistosoma mansoni neuropeptide F-like receptor 0.0075 0.0189 0.1245
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.0075 0.0189 0.1245
Brugia malayi putative neuropeptide receptor 0.0075 0.0189 0.0917
Brugia malayi Protein kinase domain containing protein 0.0062 0.0087 0.0424
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni biogenic amine (dopamine) receptor 0.0075 0.0189 0.1245
Brugia malayi neuropeptide F receptor 0.0075 0.0189 0.0917
Echinococcus multilocularis G protein coupled receptor 139 0.0075 0.0189 0.1245
Trichomonas vaginalis fk506-binding protein, putative 0.0106 0.0432 0.2002
Loa Loa (eye worm) hypothetical protein 0.0053 0.0016 0.0016
Brugia malayi Transcription factor IIA, alpha/beta subunit family protein 0.0106 0.0435 0.2114
Brugia malayi Kringle domain containing protein 0.0062 0.0087 0.0424
Loa Loa (eye worm) hypothetical protein 0.018 0.1016 0.1016
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.008 0.0224 0.1516
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni amine GPCR 0.0075 0.0189 0.1245
Schistosoma mansoni alpha-glucosidase 0.0144 0.0733 0.5376
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis lysosomal alpha glucosidase 0.0178 0.1003 0.7431
Onchocerca volvulus 0.0075 0.0189 0.1559
Onchocerca volvulus 0.0075 0.0189 0.1559
Schistosoma mansoni opsin-like receptor 0.0075 0.0189 0.1245
Echinococcus granulosus tm gpcr rhodopsin 0.0075 0.0189 0.1245
Trichomonas vaginalis glucosylceramidase, putative 0.0205 0.1211 0.5832
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0261 0.1657 1
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0075 0.0189 0.1245
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0076 0.0194 0.1285
Echinococcus granulosus lysosomal alpha glucosidase 0.0178 0.1003 0.7431
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0106 0.0427 0.2077
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0075 0.0189 0.0917
Schistosoma mansoni neuropeptide receptor 0.0075 0.0189 0.1245
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Loa Loa (eye worm) hypothetical protein 0.0075 0.0189 0.0189
Schistosoma mansoni peptide (allatostatin)-like receptor 0.0075 0.0189 0.1245
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0075 0.0189 0.1245

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 1.2 uM Inhibition of coffee bean alpha-galactosidase assessed as p-nitrophenol release at pH 6.5 by spectrometric analysis ChEMBL. 20457528
IC50 (binding) = 10 uM Inhibition of rice alpha-glucosidase assessed as D-glucose release at pH 5 after 10 to 30 mins ChEMBL. 20457528
IC50 (binding) = 15 uM Inhibition of human lysosome alpha-galactosidase assessed as p-nitrophenol release by spectrometric analysis ChEMBL. 20457528
IC50 (binding) = 152 uM Inhibition of Caldocellum saccharolyticum beta-glucosidase assessed as p-nitrophenol release at pH 5 by spectrometric analysis ChEMBL. 20457528
Inhibition (binding) < 50 % Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release at 1000 uM at pH 4.5 by spectrometric analysis ChEMBL. 20457528
Inhibition (binding) < 50 % Inhibition of rat intestinal lactase assessed as p-nitrophenol release at 1000 uM by spectrometric analysis ChEMBL. 20457528
Inhibition (binding) < 50 % Inhibition of bovine epididymis alpha-L-fucosidase assessed as p-nitrophenol release at 1000 uM at pH 5.5 by spectrometric analysis ChEMBL. 20457528
Inhibition (binding) < 50 % Inhibition of pig kidney trehalase assessed as p-nitrophenol release at 1000 uM at pH 6.5 by spectrometric analysis ChEMBL. 20457528

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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