Detailed information for compound 938186

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 447.477 | Formula: C20H33NO10
  • H donors: 4 H acceptors: 4 LogP: -1.13 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CO[C@@H]1[C@H]2OCO[C@H]([C@H]2O[C@@H]([C@H]1O)CO)NC(=O)[C@H]([C@@]1(OC)CC(=C)[C@H]([C@H](O1)C)C)O
  • InChi: 1S/C20H33NO10/c1-9-6-20(27-5,31-11(3)10(9)2)17(24)18(25)21-19-16-15(28-8-29-19)14(26-4)13(23)12(7-22)30-16/h10-17,19,22-24H,1,6-8H2,2-5H3,(H,21,25)/t10-,11-,12-,13-,14+,15-,16+,17-,19-,20-/m1/s1
  • InChiKey: MCZXTZIIMNQSRN-KERYRKMBSA-N  

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Trichomonas vaginalis histone deacetylase, putative 0.0333 0.0706 1
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Onchocerca volvulus Histone deacetylase 10 homolog 0.0151 0.031 0.9126
Loa Loa (eye worm) phosphatidylinositol glycan anchor biosynthesis protein 0.0046 0.0082 0.0081
Echinococcus granulosus sex peptide receptor 0.0009 0.0002 0.0014
Echinococcus granulosus BRCA1 associated protein 0.0012 0.0008 0.0082
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) histone deacetylase 11 0.0151 0.031 0.031
Trichomonas vaginalis glucosylceramidase, putative 0.0173 0.0359 0.5031
Brugia malayi TATA binding protein associated factor 0.0012 0.0008 0.0008
Loa Loa (eye worm) hypothetical protein 0.0017 0.0019 0.0018
Leishmania major modification methylase-like protein 0.002 0.0025 0.0017
Echinococcus granulosus disco interacting protein 2 0.0039 0.0066 0.0671
Trypanosoma cruzi histone deacetylase, putative 0.0333 0.0707 0.07
Echinococcus multilocularis alpha 1A adrenergic receptor 0.0009 0.0002 0.0014
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0012 0.0008 0.0077
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Trichomonas vaginalis glucosamine-6-phosphate isomerase, putative 0.0046 0.0082 0.1059
Plasmodium vivax N-acetylglucosaminylphosphatidylinositol deacetylase, putative 0.0046 0.0082 0.1056
Echinococcus multilocularis histone deacetylase 1 0.0333 0.0706 0.7245
Schistosoma mansoni UDP-glucose 4-epimerase 0.0052 0.0094 0.1265
Echinococcus multilocularis thyrotropin releasing hormone receptor 0.0009 0.0002 0.0014
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0012 0.0008 0.0008
Brugia malayi Serotonin receptor 0.0009 0.0002 0.0002
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0012 0.0008 0.0008
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0078 0.08
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0034 0.0056 0.0746
Trichomonas vaginalis histone deacetylase, putative 0.0333 0.0706 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Echinococcus multilocularis tar DNA binding protein 0.0065 0.0122 0.1253
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0012 0.0008 0.0008
Brugia malayi sulfakinin receptor protein 0.0009 0.0002 0.0002
Echinococcus multilocularis tachykinin peptides receptor 99D 0.0009 0.0002 0.0014
Echinococcus granulosus neuropeptide FF receptor 2 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus multilocularis neuropeptide Y receptor 0.0009 0.0002 0.0014
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Trypanosoma cruzi N-Acetyl-D-glucosaminylphosphatidylinositol de-N-acetylase, putative 0.0046 0.0082 0.0074
Echinococcus granulosus histone deacetylase 8 0.0151 0.031 0.3182
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) histone deacetylase 0.0333 0.0707 0.0707
Toxoplasma gondii UBA/TS-N domain-containing protein 0.0012 0.0008 0.0006
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0009 0.0002 0.0002
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0009 0.0002 0.0001
Echinococcus multilocularis dro:myosuppressin receptor 0.0009 0.0002 0.0014
Schistosoma mansoni hypothetical protein 0.0017 0.0019 0.0231
Echinococcus multilocularis somatostatin receptor 0.0009 0.0002 0.0014
Echinococcus granulosus histone deacetylase 1 0.0333 0.0706 0.7245
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Trichomonas vaginalis BRCA1-associated protein, putative 0.0012 0.0008 0.0006
Toxoplasma gondii N-acetylglucosaminylphosphatidylinositol deacetylase 0.0046 0.0082 0.1056
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0012 0.0008 0.0077
Echinococcus multilocularis fmrfamide receptor 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0022 0.003 0.003
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.034 0.4754
Schistosoma mansoni brca1-associated protein (brap2) 0.0012 0.0008 0.0089
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 5 0.0012 0.0008 0.0082
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) ubiquitin carboxyl-terminal hydrolase 0.0012 0.0008 0.0008
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.0009 0.0002 0.0001
Entamoeba histolytica N-acetylglucosaminyl-phosphatidylinositol de-N-acetylase, putative 0.0046 0.0082 0.1053
Echinococcus multilocularis 7TM GPCR, rhodopsin 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0008
Plasmodium vivax histone deacetylase, putative 0.0151 0.031 0.4322
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0009 0.0002 0.0014
Echinococcus multilocularis pyroglutamylated rfamide peptide receptor 0.0009 0.0002 0.0014
Schistosoma mansoni histone deacetylase 4 5 0.0333 0.0707 0.9635
Echinococcus multilocularis g protein coupled receptor 0.0009 0.0002 0.0014
Loa Loa (eye worm) ubiquitin carboxyl-terminal hydrolase 0.0012 0.0008 0.0008
Echinococcus granulosus tm gpcr rhodopsin 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Toxoplasma gondii histone deacetylase HDAC1 0.0333 0.0707 1
Loa Loa (eye worm) histone deacetylase 7A 0.0333 0.0707 0.0707
Echinococcus granulosus tm gpcr rhodopsin 0.0009 0.0002 0.0014
Brugia malayi neuropeptide F receptor 0.0009 0.0002 0.0002
Loa Loa (eye worm) UDP galactose 4'-epimerase 0.0052 0.0094 0.0094
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0078 0.1045
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 22 0.0012 0.0008 0.0082
Schistosoma mansoni histone deacetylase 4 5 0.0333 0.0707 0.9635
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.034 0.4754
Schistosoma mansoni histone deacetylase hda2 0.0346 0.0734 1
Trypanosoma cruzi C-8 sterol isomerase, putative 0.4603 1 1
Echinococcus multilocularis growth hormone secretagogue receptor type 1 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0151 0.031 0.031
Echinococcus granulosus DNA methyltransferase 2, putative 0.002 0.0025 0.025
Echinococcus multilocularis g protein coupled receptor 0.0009 0.0002 0.0014
Trypanosoma cruzi histone deacetylase, putative 0.0333 0.0707 0.07
Onchocerca volvulus 0.0012 0.0008 0.0182
Plasmodium falciparum cysteine repeat modular protein 1 0.0017 0.0019 0.0154
Leishmania major histone deacetylase, putative 0.0333 0.0707 0.07
Brugia malayi BRCA1-associated protein 2 containing protein 0.0012 0.0008 0.0008
Echinococcus multilocularis G protein coupled 5 hydroxytryptamine receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0078 0.08
Echinococcus granulosus histone deacetylase 6 0.0333 0.0707 0.726
Loa Loa (eye worm) hypothetical protein 0.2352 0.5102 0.5102
Brugia malayi histone deacetylase 11 0.0151 0.031 0.031
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0122 0.1647
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0009 0.0002 0.0002
Brugia malayi hypothetical protein 0.0012 0.0008 0.0008
Trichomonas vaginalis histone deacetylase, putative 0.0333 0.0706 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Echinococcus multilocularis histone deacetylase 7 0.0333 0.0707 0.726
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0085 0.0166 0.2265
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0009 0.0002 0.0002
Echinococcus multilocularis u4:u6.u5 tri snrnp associated protein 2 0.0012 0.0008 0.0082
Loa Loa (eye worm) G-protein coupled receptor 0.0009 0.0002 0.0001
Leishmania major N-acetyl-D-acetylglucosaminylphosphatidylinositol deacetylase 0.0046 0.0082 0.0074
Trichomonas vaginalis histone deacetylase, putative 0.0333 0.0706 1
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0012 0.0008 0.0006
Brugia malayi AKH receptor 0.0009 0.0002 0.0002
Echinococcus multilocularis DNA methyltransferase 2, putative 0.002 0.0025 0.025
Loa Loa (eye worm) TAR-binding protein 0.0065 0.0122 0.0122
Trypanosoma brucei C-8 sterol isomerase, putative 0.4603 1 1
Schistosoma mansoni disco-interacting protein 2 (dip2) 0.0039 0.0066 0.0873
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0251 0.0527 0.0527
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0078 0.1045
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0009 0.0002 0.0002
Brugia malayi neuropeptide F receptor 0.0009 0.0002 0.0002
Brugia malayi RNA binding protein 0.0065 0.0122 0.0122
Echinococcus multilocularis neuropeptides capa receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis neuropeptides capa receptor 0.0009 0.0002 0.0014
Plasmodium falciparum DNA (cytosine-5)-methyltransferase 0.002 0.0025 0.024
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Echinococcus granulosus neuropeptide receptor 0.0009 0.0002 0.0014
Echinococcus granulosus histone deacetylase 0.0333 0.0707 0.726
Brugia malayi larval opioid receptor 0.0009 0.0002 0.0002
Loa Loa (eye worm) TATA binding protein associated factor 0.0012 0.0008 0.0008
Brugia malayi Peptidase family M1 containing protein 0.0012 0.0008 0.0008
Brugia malayi Tachykinin-like peptides receptor 99D 0.0009 0.0002 0.0002
Trypanosoma cruzi histone deacetylase, putative 0.0151 0.031 0.0302
Toxoplasma gondii hypothetical protein 0.0085 0.0166 0.2265
Trypanosoma cruzi histone deacetylase 1, putative 0.0333 0.0706 0.0698
Plasmodium falciparum histone deacetylase 2 0.0333 0.0707 1
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Echinococcus granulosus thyrotropin releasing hormone receptor 0.0009 0.0002 0.0014
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus granulosus 7tm_1 domain containing protein 0.0009 0.0002 0.0014
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.0078 0.0078
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Trypanosoma cruzi Aminopeptidase M1, putative 0.0034 0.0056 0.0049
Echinococcus granulosus tar DNA binding protein 0.0065 0.0122 0.1253
Brugia malayi G protein-coupled receptor F59B2.13 0.0009 0.0002 0.0002
Echinococcus multilocularis histone deacetylase 8 0.0151 0.031 0.3182
Echinococcus multilocularis peptide (allatostatin:somatostatin) 0.0009 0.0002 0.0014
Loa Loa (eye worm) melatonin receptor type 1A 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Brugia malayi G protein-coupled receptor 0.0009 0.0002 0.0002
Echinococcus multilocularis histone deacetylase 6 0.0333 0.0707 0.726
Brugia malayi GnHR receptor homolog 0.0009 0.0002 0.0002
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0034 0.0056 0.0575
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 22 0.0012 0.0008 0.0082
Onchocerca volvulus Glucosylceramidase homolog 0.0165 0.034 1
Echinococcus granulosus neuropeptide receptor A26 0.0456 0.0974 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Giardia lamblia Glucosamine-6-phosphate isomerase, putative 0.0046 0.0082 0.1053
Echinococcus multilocularis neuropeptide receptor A26 0.0456 0.0974 1
Entamoeba histolytica glucosamine-6-phosphate isomerase, putative 0.0046 0.0082 0.1053
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Plasmodium vivax histone deacetylase, putative 0.0333 0.0707 1
Echinococcus granulosus G protein coupled receptor 139 0.0009 0.0002 0.0014
Echinococcus granulosus histone deacetylase 3 0.0333 0.0706 0.7245
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0078 0.08
Loa Loa (eye worm) hypothetical protein 0.0333 0.0706 0.0705
Brugia malayi UDP galactose 4'-epimerase 0.0052 0.0094 0.0094
Echinococcus granulosus tissue type plasminogen activator 0.0017 0.0019 0.0188
Loa Loa (eye worm) G-protein coupled receptor 0.0009 0.0002 0.0001
Brugia malayi histone deacetylase 3 (HD3) 0.0333 0.0706 0.0706
Echinococcus multilocularis N acetylglucosaminyl phosphatidylinositol 0.0046 0.0082 0.0836
Brugia malayi Serotonin receptor 0.0009 0.0002 0.0002
Schistosoma mansoni N-acetylglucosaminyl-phosphatidylinositol de-n-acetylase 0.0046 0.0082 0.1093
Echinococcus granulosus histone deacetylase 6 0.0346 0.0734 0.7535
Loa Loa (eye worm) neuropeptide F receptor 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0182 0.0379 0.0378
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Trypanosoma cruzi N-Acetyl-D-glucosaminylphosphatidylinositol de-N-acetylase, putative 0.0046 0.0082 0.0074
Trypanosoma brucei N-acetyl-D-glucosaminylphosphatidylinositol de-N-acetylase 0.0046 0.0082 0.0074
Echinococcus granulosus tachykinin peptides receptor 99D 0.0009 0.0002 0.0014
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.034 0.4754
Schistosoma mansoni histone deacetylase hda2 0.0151 0.031 0.4212
Entamoeba histolytica aminopeptidase, putative 0.0034 0.0056 0.069
Loa Loa (eye worm) ubiquitin carboxyl-terminal hydrolase 0.0012 0.0008 0.0008
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.0527 0.7444
Plasmodium falciparum ubiquitin carboxyl-terminal hydrolase 13, putative 0.0012 0.0008 0.0006
Trypanosoma cruzi UDP-galactose 4-epimerase, putative 0.0052 0.0094 0.0087
Echinococcus multilocularis cpg binding protein 0.0063 0.0119 0.1217
Plasmodium vivax hypothetical protein, conserved 0.0012 0.0008 0.0006
Echinococcus granulosus neuropeptide Y receptor 0.0009 0.0002 0.0014
Mycobacterium tuberculosis Mycothiol conjugate amidase Mca (mycothiol S-conjugate amidase) 0.4046 0.8788 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0061 0.0115 0.0115
Plasmodium vivax cysteine repeat modular protein 1, putative 0.0017 0.0019 0.0154
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.0527 0.7444
Loa Loa (eye worm) hypothetical protein 0.4603 1 1
Echinococcus granulosus pyroglutamylated rfamide peptide receptor 0.0009 0.0002 0.0014
Plasmodium falciparum N-acetylglucosaminylphosphatidylinositol deacetylase, putative 0.0046 0.0082 0.1056
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.034 0.4754
Echinococcus granulosus neuropeptide s receptor 0.0456 0.0974 1
Echinococcus multilocularis neuropeptide s receptor 0.0456 0.0974 1
Brugia malayi Histone deacetylase family protein 0.0333 0.0707 0.0707
Toxoplasma gondii histone deacetylase HDAC5 0.0151 0.031 0.4322
Schistosoma mansoni cpg binding protein 0.0063 0.0119 0.16
Toxoplasma gondii UDP-glucose 4-epimerase 0.0052 0.0094 0.1237
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) aminopeptidase N 0.0034 0.0056 0.0056
Trypanosoma cruzi histone deacetylase, putative 0.0151 0.031 0.0302
Echinococcus granulosus g-protein coupled receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Plasmodium falciparum U4/U6.U5 tri-snRNP-associated protein 2, putative 0.0012 0.0008 0.0006
Schistosoma mansoni aminopeptidase A (M01 family) 0.0012 0.0008 0.0084
Echinococcus granulosus growth hormone secretagogue receptor type 1 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Brugia malayi Uncharacterized LmbE-like protein, COG2120 containing protein 0.0046 0.0082 0.0082
Onchocerca volvulus 0.0017 0.0019 0.05
Echinococcus multilocularis disco interacting protein 2 0.0039 0.0066 0.0671
Loa Loa (eye worm) hypothetical protein 0.0039 0.0066 0.0065
Leishmania major histone deacetylase, putative 0.0333 0.0706 0.0698
Entamoeba histolytica DNA (cytosine-5)-methyltransferase, putative 0.002 0.0025 0.0235
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0333 0.0706 1
Brugia malayi Kringle domain containing protein 0.0017 0.0019 0.0019
Echinococcus granulosus N acetylglucosaminyl phosphatidylinositol 0.0046 0.0082 0.0836
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Brugia malayi G-protein coupled receptor 0.0009 0.0002 0.0002
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Leishmania major udp-glc 4-epimerase, putative 0.005 0.009 0.0083
Loa Loa (eye worm) TK/ROR protein kinase 0.0017 0.0019 0.0018
Plasmodium vivax ubiquitin carboxyl-terminal hydrolase 13, putative 0.0012 0.0008 0.0006
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0122 0.1647
Echinococcus granulosus UDP glucose 4 epimerase 0.0052 0.0094 0.0966
Brugia malayi Peptidase family M1 containing protein 0.0117 0.0236 0.0236
Trypanosoma brucei histone deacetylase 1 0.0333 0.0706 0.0698
Echinococcus granulosus tm gpcr rhodopsin 0.0009 0.0002 0.0014
Toxoplasma gondii histone deacetylase HDAC2 0.0333 0.0706 0.9979
Toxoplasma gondii kringle domain-containing protein 0.0017 0.0019 0.0154
Echinococcus multilocularis neuropeptide receptor 0.0009 0.0002 0.0014
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0034 0.0056 0.0049
Echinococcus multilocularis aminopeptidase N 0.0117 0.0236 0.2417
Brugia malayi TAR-binding protein 0.0065 0.0122 0.0122
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0122 0.1647
Echinococcus multilocularis orexin receptor type 2 0.0009 0.0002 0.0014
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.0122 0.0122
Brugia malayi Protein kinase domain containing protein 0.0017 0.0019 0.0019
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0012 0.0008 0.0084
Echinococcus granulosus cpg binding protein 0.0063 0.0119 0.1217
Plasmodium vivax histone deacetylase 1, putative 0.0333 0.0706 0.9979
Brugia malayi Melatonin receptor type 1A 0.0009 0.0002 0.0002
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0251 0.0527 0.0527
Brugia malayi G-protein coupled receptor 0.0009 0.0002 0.0002
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0012 0.0008 0.0006
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.011 0.1483
Echinococcus granulosus serotonin receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis neuropeptide Y receptor 0.0009 0.0002 0.0014
Leishmania major histone deacetylase, putative 0.0333 0.0706 0.0698
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0122 0.1647
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0122 0.1647
Toxoplasma gondii Zn-finger in ubiquitin-hydrolases domain-containing protein 0.0012 0.0008 0.0006
Leishmania major hypothetical protein, conserved 0.0017 0.0019 0.0011
Loa Loa (eye worm) hypothetical protein 0.0195 0.0405 0.0405
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0022 0.003 0.0305
Trypanosoma cruzi histone deacetylase 1, putative 0.0333 0.0706 0.0698
Schistosoma mansoni family C19 non-peptidase homologue (C19 family) 0.0012 0.0008 0.0089
Schistosoma mansoni ubiquitin-specific peptidase 44 (C19 family) 0.0012 0.0008 0.0089
Loa Loa (eye worm) neuropeptide F receptor 0.0009 0.0002 0.0001
Echinococcus granulosus g protein coupled receptor 0.0009 0.0002 0.0014
Toxoplasma gondii histone deacetylase HDAC4 0.0151 0.031 0.4322
Trypanosoma brucei cytosine-specific DNA methylase, putative 0.002 0.0025 0.0017
Echinococcus granulosus G protein coupled 5 hydroxytryptamine receptor 0.0009 0.0002 0.0014
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Trichomonas vaginalis brca1-associated protein, putative 0.0012 0.0008 0.0006
Onchocerca volvulus 0.0117 0.0236 0.6923
Onchocerca volvulus 0.0034 0.0056 0.1617
Echinococcus multilocularis histone deacetylase 0.0333 0.0707 0.726
Schistosoma mansoni histone deacetylase 0.0333 0.0706 0.9615
Echinococcus granulosus neuropeptides capa receptor 0.0009 0.0002 0.0014
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.0527 0.7444
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Brugia malayi follicle stimulating hormone receptor 0.0009 0.0002 0.0002
Brugia malayi hypothetical protein 0.0034 0.0056 0.0056
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Echinococcus granulosus u4:u6.u5 tri snrnp associated protein 2 0.0012 0.0008 0.0082
Plasmodium falciparum histone deacetylase, putative 0.0333 0.0707 1
Echinococcus multilocularis histone deacetylase 6 0.0333 0.0707 0.726
Trypanosoma brucei Aminopeptidase M1, putative 0.0034 0.0056 0.0049
Loa Loa (eye worm) histone deacetylase 3 0.0333 0.0706 0.0705
Echinococcus granulosus neuropeptide receptor 0.0009 0.0002 0.0014
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.0078 0.0078
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0012 0.0008 0.0006
Echinococcus granulosus g protein coupled receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis fmrfamide receptor 0.0009 0.0002 0.0014
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0009 0.0002 0.0002
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0034 0.0056 0.0049
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Trypanosoma brucei UDP-galactose 4-epimerase 0.005 0.009 0.0083
Trypanosoma cruzi UDP-galactose 4-epimerase 0.0052 0.0094 0.0087
Brugia malayi putative neuropeptide receptor 0.0009 0.0002 0.0002
Trichomonas vaginalis NAD dependent epimerase/dehydratase, putative 0.0052 0.0094 0.124
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0009 0.0002 0.0014
Trypanosoma brucei histone deacetylase 4 0.0333 0.0707 0.07
Giardia lamblia Histone deacetylase 0.0333 0.0706 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus multilocularis BRCA1 associated protein 0.0012 0.0008 0.0082
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Trichomonas vaginalis glucosylceramidase, putative 0.0173 0.0359 0.5031
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Brugia malayi Dopamine receptor 0.0009 0.0002 0.0002
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus multilocularis G-protein coupled receptor, putative 0.0009 0.0002 0.0014
Brugia malayi Histone deacetylase family protein 0.0333 0.0707 0.0707
Schistosoma mansoni cpg binding protein 0.0063 0.0119 0.16
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Trypanosoma cruzi histone deacetylase, putative 0.0333 0.0707 0.07
Echinococcus granulosus allatostatin A receptor 0.0009 0.0002 0.0014
Schistosoma mansoni DNA (cytosine-5)-methyltransferase 0.002 0.0025 0.0313
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Trypanosoma brucei Aminopeptidase M1, putative 0.0034 0.0056 0.0049
Loa Loa (eye worm) BRCA1-associated protein 2 containing protein 0.0012 0.0008 0.0008
Brugia malayi Histone deacetylase 1 0.0333 0.0706 0.0706
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.034 0.4754
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0333 0.0706 1
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Toxoplasma gondii C-5 cytosine-specific DNA methylase superfamily protein 0.002 0.0025 0.024
Mycobacterium leprae Mycothiol conjugate amidase Mca (Mycothiol S-conjugate amidase) 0.4092 0.8889 1
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Brugia malayi CXXC zinc finger family protein 0.0061 0.0115 0.0115
Echinococcus multilocularis serotonin receptor 0.0009 0.0002 0.0014
Echinococcus granulosus biogenic amine 5HT receptor 0.0009 0.0002 0.0014
Mycobacterium ulcerans mycothiol conjugate amidase Mca 0.4092 0.8889 1
Leishmania major histone deacetylase, putative 0.0333 0.0707 0.07
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Toxoplasma gondii DNA methyltransferase 2, putative 0.002 0.0025 0.024
Echinococcus granulosus histone deacetylase 7 0.0333 0.0707 0.726
Echinococcus granulosus histone deacetylase 6 0.0333 0.0707 0.726
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0034 0.0056 0.0049
Echinococcus granulosus alpha 1A adrenergic receptor 0.0009 0.0002 0.0014
Plasmodium falciparum histone deacetylase 1 0.0333 0.0706 0.9979
Echinococcus granulosus somatostatin receptor 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) TYRA-2 protein 0.0009 0.0002 0.0001
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.0122 0.0122
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.0527 0.7444
Loa Loa (eye worm) RNA binding protein 0.0065 0.0122 0.0122
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.034 0.4754
Loa Loa (eye worm) hypothetical protein 0.0105 0.0209 0.0209
Schistosoma mansoni ubiquitin-specific peptidase 5 (C19 family) 0.0012 0.0008 0.0089
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0012 0.0008 0.0084
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Entamoeba histolytica UDP-glucose 4-epimerase, putative 0.0052 0.0094 0.1235
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0009 0.0002 0.0014
Trichomonas vaginalis glucosylceramidase, putative 0.0165 0.034 0.4754
Echinococcus multilocularis neuropeptide FF receptor 2 0.0009 0.0002 0.0014
Trypanosoma brucei histone deacetylase, putative 0.0333 0.0707 0.07
Loa Loa (eye worm) peptidase family M1 containing protein 0.0094 0.0187 0.0187
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.0527 0.7444
Loa Loa (eye worm) ubiquitin specific peptidase 39 0.0012 0.0008 0.0008
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0012 0.0008 0.0006
Brugia malayi Dopamine receptor protein 2 0.0009 0.0002 0.0002
Trypanosoma brucei histone deacetylase 2 0.0151 0.031 0.0302
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Plasmodium vivax histone deacetylase 2, putative 0.0333 0.0707 1
Echinococcus multilocularis tissue type plasminogen activator 0.0017 0.0019 0.0188
Toxoplasma gondii histone deacetylase HDAC3 0.0333 0.0706 0.9979
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Brugia malayi Disco-interacting protein 2 homolog 0.0039 0.0066 0.0066
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus granulosus neuropeptides capa receptor 0.0009 0.0002 0.0014
Trypanosoma cruzi aminopeptidase, putative 0.0034 0.0056 0.0049
Echinococcus multilocularis UDP glucose 4 epimerase 0.0052 0.0094 0.0966
Onchocerca volvulus 0.0039 0.0066 0.1891
Toxoplasma gondii ubiquitin specific protease 39 isoform 2, putative 0.0012 0.0008 0.0006
Leishmania major C-8 sterol isomerase-like protein 0.4603 1 1
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0034 0.0056 0.0575
Brugia malayi Dopamine receptor protein 1 0.0009 0.0002 0.0002
Trichomonas vaginalis NAD dependent epimerase/dehydratase, putative 0.0052 0.0094 0.124
Brugia malayi RE15519p 0.0009 0.0002 0.0002
Echinococcus granulosus 7TM GPCR rhodopsin 0.0009 0.0002 0.0014
Brugia malayi histone deacetylase 1 (HD1) 0.0333 0.0706 0.0706
Trichomonas vaginalis histone deacetylase, putative 0.0333 0.0706 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus multilocularis sex peptide receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis g protein linked acetylcholine receptor gar 2a 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0009 0.0002 0.0014
Echinococcus multilocularis g protein coupled receptor 0.0009 0.0002 0.0014
Schistosoma mansoni histone deacetylase 0.0333 0.0706 0.9615
Echinococcus granulosus aminopeptidase N 0.0117 0.0236 0.2417
Trichomonas vaginalis UDP-glucose 4-epimerase, putative 0.0052 0.0094 0.124
Brugia malayi putative neuropeptide receptor NPR1 0.0009 0.0002 0.0002
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0034 0.0056 0.0695
Echinococcus multilocularis serotonin receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis g-protein coupled receptor 0.0009 0.0002 0.0014
Echinococcus granulosus orexin receptor type 2 0.0009 0.0002 0.0014
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0008
Brugia malayi Peptidase family M1 containing protein 0.0034 0.0056 0.0056
Onchocerca volvulus Uncharacterized RING finger protein homolog 0.0012 0.0008 0.0194
Trichomonas vaginalis histone deacetylase, putative 0.0333 0.0706 1
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0012 0.0008 0.0008
Echinococcus granulosus fmrfamide receptor 0.0009 0.0002 0.0014
Plasmodium vivax U4/U6.U5 tri-snRNP-associated protein 2, putative 0.0012 0.0008 0.0006
Schistosoma mansoni cpg binding protein 0.0061 0.0115 0.1552
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0022 0.003 0.0022
Echinococcus granulosus neuropeptide Y receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis allatostatin A receptor 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0022 0.003 0.003
Echinococcus multilocularis G protein coupled receptor 139 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.0096 0.1268
Echinococcus multilocularis rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Echinococcus granulosus peptide allatostatin:somatostatin 0.0009 0.0002 0.0014
Schistosoma mansoni brca1-associated protein (brap2) 0.0012 0.0008 0.0089
Onchocerca volvulus 0.0061 0.0115 0.3364
Schistosoma mansoni histone deacetylase 1 2 3 0.0151 0.031 0.4212
Plasmodium vivax DNA (cytosine-5)-methyltransferase, putative 0.002 0.0025 0.024
Echinococcus granulosus g protein linked acetylcholine receptor gar 2a 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0082 0.0161 0.0161
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.0009 0.0002 0.0001
Trichomonas vaginalis glucosylceramidase, putative 0.0251 0.0527 0.7444
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Brugia malayi hypothetical protein 0.0009 0.0002 0.0002
Plasmodium falciparum ubiquitin carboxyl-terminal hydrolase, putative 0.0012 0.0008 0.0006
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0012 0.0008 0.0006
Brugia malayi ORL1-like opioid receptor 0.0009 0.0002 0.0002
Echinococcus granulosus hypothetical protein 0.0009 0.0002 0.0014
Loa Loa (eye worm) histone deacetylase 1 0.0333 0.0706 0.0705
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus multilocularis tm gpcr rhodopsin gpcr rhodopsin superfamily 0.0009 0.0002 0.0014
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Echinococcus granulosus rhodopsin orphan GPCR 0.0009 0.0002 0.0014
Echinococcus granulosus g protein coupled receptor 0.0009 0.0002 0.0014
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0012 0.0008 0.0008
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0034 0.0056 0.0695
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0078 0.08
Echinococcus multilocularis neuropeptide receptor 0.0009 0.0002 0.0014
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0037 0.0061 0.0817
Echinococcus granulosus leukotriene A 4 hydrolase 0.0012 0.0008 0.0077
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0012 0.0008 0.0077
Giardia lamblia UDP-glucose 4-epimerase 0.005 0.009 0.1178
Echinococcus multilocularis histone deacetylase 6 0.0346 0.0734 0.7535
Trypanosoma brucei histone deacetylase 3 0.0333 0.0707 0.07
Loa Loa (eye worm) hypothetical protein 0.0009 0.0002 0.0001
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.0022 0.003 0.0387
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0034 0.0056 0.0049
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0333 0.0706 1
Mycobacterium ulcerans aminopeptidase N PepN 0.0034 0.0056 0.0055
Echinococcus multilocularis biogenic amine (5HT) receptor 0.0009 0.0002 0.0014
Echinococcus granulosus dro:myosuppressin receptor 0.0009 0.0002 0.0014
Trypanosoma cruzi hypothetical protein, conserved 0.0017 0.0019 0.0011
Mycobacterium ulcerans N-acetyl-1-D-myo-inosityl-2-amino-2-deoxy-alpha-D-glucopyranoside deacetylase MshB 0.0046 0.0082 0.0083
Entamoeba histolytica histone deacetylase, putative 0.0333 0.0706 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0078 0.1045
Echinococcus granulosus biogenic amine 5HT receptor 0.0009 0.0002 0.0014
Echinococcus multilocularis histone deacetylase 3 0.0333 0.0706 0.7245

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) > 10 ug ml-1 In vitro inhibitory concentration for cytotoxic activity was tested against HeLa cells ChEMBL. No reference
IC50 (functional) > 50 ug ml-1 In vitro inhibitory concentration for antiviral activity was tested against HEL cells ChEMBL. No reference
MIC (functional) = 25 ug ml-1 In vitro minimum inhibitory concentration for antiviral activity was tested against Varicella-zoster virus(VZV) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23

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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