Detailed information for compound 581522

Basic information

Technical information
  • TDR Targets ID: 581522
  • Name: 10-hydroxycoronaridine
  • MW: 354.443 | Formula: C21H26N2O3
  • H donors: 2 H acceptors: 2 LogP: 3.18 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC[C@H]1C[C@H]2CN3[C@@H]1[C@](C2)(C(=O)OC)c1[nH]c2c(c1CC3)cc(cc2)O
  • InChi: 1S/C21H26N2O3/c1-3-13-8-12-10-21(20(25)26-2)18-15(6-7-23(11-12)19(13)21)16-9-14(24)4-5-17(16)22-18/h4-5,9,12-13,19,22,24H,3,6-8,10-11H2,1-2H3/t12-,13+,19+,21-/m1/s1
  • InChiKey: TUZCJNZERFWZAS-YDBSYXHISA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 76129-67-4
  • Ibogamine-18-carboxylic acid, 12-hydroxy-, methyl ester

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
Schistosoma mansoni hypothetical protein 0.0169 0.0133 0.0132
Trichomonas vaginalis beta-mannosidase, putative 0.0102 0.0061 0.0034
Loa Loa (eye worm) hypothetical protein 0.5093 0.5493 0.5493
Schistosoma mansoni alpha-amylase 0.0123 0.0083 0.0078
Loa Loa (eye worm) hypothetical protein 0.0207 0.0175 0.0175
Mycobacterium tuberculosis Trehalose synthase TreS 0.0123 0.0083 0.5
Trichomonas vaginalis glucosylceramidase, putative 0.6384 0.6899 0.6891
Loa Loa (eye worm) glycosyl hydrolase family 2 0.0178 0.0143 0.0143
Trichomonas vaginalis glucosylceramidase, putative 0.6058 0.6544 0.6535
Echinococcus granulosus beta hexosaminidase subunit alpha 0.0071 0.0027 0.0018
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.9233 1 1
Mycobacterium ulcerans trehalose synthase TreS 0.0123 0.0083 0.5
Onchocerca volvulus Glucosylceramidase homolog 0.6058 0.6544 0.7043
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0092 0.005 0.0043
Brugia malayi Beta-glucuronidase precursor 0.017 0.0134 0.0134
Treponema pallidum hypothetical protein 0.0047 0 0.5
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.01 0.0058 0.0052
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.1468 0.1548 1
Echinococcus multilocularis beta galactosidase 0.0149 0.0111 0.0109
Onchocerca volvulus 0.0136 0.0097 0.0093
Brugia malayi Alpha amylase, catalytic domain containing protein 0.0123 0.0083 0.0083
Giardia lamblia Ceramide glucosyltransferase 0.3889 0.4182 1
Trichomonas vaginalis glucosylceramidase, putative 0.9233 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.005 0.0043
Mycobacterium tuberculosis Probable alpha-glucosidase AglA (maltase) (glucoinvertase) (glucosidosucrase) (maltase-glucoamylase) (lysosomal alpha-glucosidas 0.0123 0.0083 0.5
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.1468 0.1548 0.1525
Echinococcus multilocularis lysosomal alpha glucosidase 0.8174 0.8847 0.9526
Echinococcus multilocularis ceramide glucosyltransferase 0.8578 0.9287 1
Trichomonas vaginalis glucosylceramidase, putative 0.6058 0.6544 0.6535
Trichomonas vaginalis conserved hypothetical protein 0.0106 0.0065 0.0038
Brugia malayi hypothetical protein 0.0048 0.0001 0.0001
Brugia malayi manba-prov protein 0.0102 0.0061 0.0061
Schistosoma mansoni beta-mannosidase 0.0102 0.0061 0.0054
Trichomonas vaginalis conserved hypothetical protein 0.0136 0.0097 0.007
Entamoeba histolytica glycogen debranching enzyme, putative 0.0207 0.0175 0.0628
Echinococcus granulosus alpha glucosidase 0.0123 0.0083 0.0078
Trichomonas vaginalis alpha-glucosidase, putative 0.1468 0.1548 0.1525
Schistosoma mansoni alpha-glucosidase 0.7501 0.8115 0.8737
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.8174 0.8847 0.8847
Brugia malayi Intermediate filament tail domain containing protein 0.0056 0.001 0.001
Echinococcus multilocularis glycogen debranching enzyme 0.0207 0.0175 0.0178
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0796 0.0816 0.0791
Trichomonas vaginalis glycogen debranching enzyme, putative 0.0207 0.0175 0.0149
Loa Loa (eye worm) ceramide glucosyltransferase 0.8578 0.9287 0.9287
Onchocerca volvulus Huntingtin homolog 0.0133 0.0094 0.009
Echinococcus granulosus neutral alpha glucosidase AB 0.1468 0.1548 0.1657
Trichomonas vaginalis alpha-glucosidase, putative 0.1468 0.1548 0.1525
Loa Loa (eye worm) hypothetical protein 0.0054 0.0008 0.0008
Trichomonas vaginalis glycoside hydrolases, putative 0.0186 0.0152 0.0126
Trichomonas vaginalis alpha-glucosidase, putative 0.0796 0.0816 0.0791
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0092 0.005 0.0043
Echinococcus granulosus non lysosomal glucosylceramidase 0.7545 0.8162 0.8788
Schistosoma mansoni hypothetical protein 0.0267 0.024 0.0247
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.0058 0.0052
Loa Loa (eye worm) hypothetical protein 0.0169 0.0133 0.0133
Loa Loa (eye worm) alpha amylase 0.0123 0.0083 0.0083
Brugia malayi Glycosyl hydrolases family 31 protein 0.0796 0.0816 0.0816
Trichomonas vaginalis glucosylceramidase, putative 0.6058 0.6544 0.6535
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.005 0.0043
Brugia malayi Trehalase family protein 0.0136 0.0097 0.0097
Echinococcus granulosus smoothened 0.0173 0.0137 0.0137
Loa Loa (eye worm) hypothetical protein 0.0449 0.0438 0.0437
Trichomonas vaginalis glucosylceramidase, putative 0.9233 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0092 0.005 0.0043
Trichomonas vaginalis alpha-glucosidase, putative 0.1468 0.1548 0.1525
Trichomonas vaginalis glucosylceramidase, putative 0.6058 0.6544 0.6535
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.01 0.0058 0.0032
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0092 0.005 0.0043
Onchocerca volvulus Huntingtin homolog 0.0133 0.0094 0.009
Loa Loa (eye worm) TRE-1 protein 0.0136 0.0097 0.0097
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0054 0.0008 0.0008
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0796 0.0816 0.0791
Schistosoma mansoni alpha-amylase 0.0123 0.0083 0.0078
Trichomonas vaginalis maltase-glucoamylase, putative 0.0796 0.0816 0.0791
Trichomonas vaginalis glucosylceramidase, putative 0.9233 1 1
Onchocerca volvulus Trehalase homolog 0.0136 0.0097 0.0093
Echinococcus granulosus ceramide glucosyltransferase 0.8578 0.9287 1
Loa Loa (eye worm) alpha amylase 0.0123 0.0083 0.0083
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0092 0.005 0.005
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0054 0.0008 0.0008
Trichomonas vaginalis alpha-glucosidase, putative 0.1468 0.1548 0.1525
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.01 0.0058 0.0052
Schistosoma mansoni hypothetical protein 0.0232 0.0202 0.0207
Trichomonas vaginalis glucosylceramidase, putative 0.6058 0.6544 0.6535
Trichomonas vaginalis glucosylceramidase, putative 0.6058 0.6544 0.6535
Onchocerca volvulus 0.0136 0.0097 0.0093
Trichomonas vaginalis beta-glucosidase, putative 0.0186 0.0152 0.0126
Trichomonas vaginalis glycoside hydrolase, putative 0.0437 0.0425 0.0399
Trichomonas vaginalis glucosylceramidase, putative 0.6384 0.6899 0.6891
Leishmania major alpha glucosidase II subunit, putative 0.1468 0.1548 1
Trichomonas vaginalis trehalase, putative 0.0136 0.0097 0.007
Schistosoma mansoni hypothetical protein 0.0169 0.0133 0.0132
Echinococcus granulosus lysosomal alpha glucosidase 0.8174 0.8847 0.9526
Echinococcus granulosus geminin 0.0169 0.0133 0.0132
Loa Loa (eye worm) hypothetical protein 0.0796 0.0816 0.0816
Trichomonas vaginalis conserved hypothetical protein 0.0315 0.0293 0.0267
Brugia malayi intermediate filament protein 0.0056 0.001 0.001
Trichomonas vaginalis alpha-glucosidase, putative 0.0796 0.0816 0.0791
Trichomonas vaginalis sucrase-isomaltase, putative 0.1468 0.1548 0.1525
Brugia malayi Ceramide glucosyltransferase 0.8578 0.9287 0.9287
Trichomonas vaginalis glucosylceramidase, putative 0.6058 0.6544 0.6535
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0056 0.001 0.001
Loa Loa (eye worm) hypothetical protein 0.0136 0.0097 0.0097
Trichomonas vaginalis alpha-glucosidase, putative 0.0796 0.0816 0.0791
Loa Loa (eye worm) hypothetical protein 0.0089 0.0046 0.0045
Loa Loa (eye worm) hypothetical protein 0.0136 0.0097 0.0097
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.0058 0.0052
Loa Loa (eye worm) beta-glucuronidase 0.017 0.0134 0.0134
Onchocerca volvulus Ceramide glucosyltransferase homolog 0.8578 0.9287 1
Schistosoma mansoni bile acid beta-glucosidase-related 0.7545 0.8162 0.8788
Loa Loa (eye worm) hypothetical protein 0.0067 0.0023 0.0022
Loa Loa (eye worm) intermediate filament protein 0.0056 0.001 0.001
Schistosoma mansoni ceramide glucosyltransferase 0.8578 0.9287 1
Loa Loa (eye worm) trehalase 0.0136 0.0097 0.0097
Brugia malayi Glycosyl hydrolases family 31 protein 0.1468 0.1548 0.1548
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0796 0.0816 0.5004
Trichomonas vaginalis maltase-glucoamylase, putative 0.1468 0.1548 0.1525
Loa Loa (eye worm) amylo-alpha-1,6-glucosidase 0.0101 0.0059 0.0059
Loa Loa (eye worm) hypothetical protein 0.0149 0.0111 0.0111
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0092 0.005 0.0043
Schistosoma mansoni alpha-amylase 0.0123 0.0083 0.0078
Echinococcus multilocularis Glycoside hydrolase, family 27 0.01 0.0058 0.0052
Brugia malayi Melibiase family protein 0.01 0.0058 0.0058
Echinococcus granulosus glycogen debranching enzyme 0.0207 0.0175 0.0178
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0796 0.0816 0.0868
Schistosoma mansoni beta-galactosidase 0.0149 0.0111 0.0109
Brugia malayi Trehalase family protein 0.0136 0.0097 0.0097
Brugia malayi Glycosyl hydrolases family 2, sugar binding domain containing protein 0.0178 0.0143 0.0143
Brugia malayi Trehalase family protein 0.0136 0.0097 0.0097
Schistosoma mansoni ceramide glucosyltransferase 0.8578 0.9287 1
Echinococcus multilocularis beta hexosaminidase subunit alpha 0.0071 0.0027 0.0018
Loa Loa (eye worm) TRE-2 protein 0.0136 0.0097 0.0097
Trypanosoma cruzi hypothetical protein, conserved 0.1468 0.1548 1
Loa Loa (eye worm) hypothetical protein 0.0133 0.0094 0.0094
Echinococcus granulosus bile acid beta glucosidase 0.7545 0.8162 0.8788
Brugia malayi Glycosyl hydrolases family 31 protein 0.8174 0.8847 0.8847
Trichomonas vaginalis alpha-glucosidase, putative 0.0796 0.0816 0.0791
Loa Loa (eye worm) hypothetical protein 0.01 0.0058 0.0058
Brugia malayi hypothetical protein 0.0136 0.0097 0.0097
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0092 0.005 0.0049
Brugia malayi Alpha amylase, catalytic domain containing protein 0.0123 0.0083 0.0083
Mycobacterium leprae Putative uncharacterized protein ML2045 0.0123 0.0083 0.5
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.0058 0.0052
Onchocerca volvulus 0.0136 0.0097 0.0093
Trichomonas vaginalis alpha-glucosidase, putative 0.0796 0.0816 0.0791
Loa Loa (eye worm) hypothetical protein 0.0136 0.0097 0.0097
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.0058 0.0052
Brugia malayi Trehalase family protein 0.0136 0.0097 0.0097
Loa Loa (eye worm) trehalase 0.0136 0.0097 0.0097
Loa Loa (eye worm) hypothetical protein 0.0133 0.0094 0.0094
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.1468 0.1548 0.1525
Schistosoma mansoni hypothetical protein 0.015 0.0112 0.011
Trichomonas vaginalis glycogen debranching enzyme, putative 0.0207 0.0175 0.0149
Brugia malayi Calcitonin receptor-like protein seb-1 0.0054 0.0008 0.0008
Echinococcus multilocularis geminin 0.0169 0.0133 0.0132
Trichomonas vaginalis glucosylceramidase, putative 0.9233 1 1
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.1468 0.1548 1
Loa Loa (eye worm) hypothetical protein 0.0136 0.0097 0.0097
Trypanosoma brucei glucosidase, putative 0.1468 0.1548 1
Trichomonas vaginalis glucosylceramidase, putative 0.9233 1 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.0058 0.0052
Echinococcus multilocularis bile acid beta glucosidase 0.7545 0.8162 0.8788
Loa Loa (eye worm) hypothetical protein 0.0055 0.0009 0.0009
Brugia malayi Amylo-alpha-1,6-glucosidase family protein 0.0207 0.0175 0.0175
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.01 0.0058 0.0052
Echinococcus multilocularis alpha glucosidase 0.0123 0.0083 0.0078
Trichomonas vaginalis glucosylceramidase, putative 0.9233 1 1
Schistosoma mansoni alpha glucosidase 0.1468 0.1548 0.1657
Echinococcus granulosus beta galactosidase 0.0149 0.0111 0.0109
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.1468 0.1548 0.1547
Loa Loa (eye worm) hypothetical protein 0.0136 0.0097 0.0097
Schistosoma mansoni bile acid beta-glucosidase-related 0.7545 0.8162 0.8788
Schistosoma mansoni alpha-glucosidase 0.7501 0.8115 0.8737
Schistosoma mansoni alpha-amylase 0.0123 0.0083 0.0078
Echinococcus multilocularis lysosomal alpha glucosidase 0.8174 0.8847 0.9526
Trichomonas vaginalis beta-galactosidase, putative 0.0315 0.0293 0.0267
Entamoeba histolytica beta-galactosidase, putative 0.0213 0.0181 0.067
Trypanosoma cruzi hypothetical protein, conserved 0.1468 0.1548 1
Echinococcus multilocularis non lysosomal glucosylceramidase 0.7545 0.8162 0.8788
Toxoplasma gondii Amylo-alpha-1,6-glucosidase 0.0207 0.0175 0.0783
Trichomonas vaginalis alpha-glucosidase, putative 0.1468 0.1548 0.1525
Echinococcus multilocularis smoothened 0.0173 0.0137 0.0137
Onchocerca volvulus 0.533 0.5751 0.6188
Loa Loa (eye worm) hypothetical protein 0.0056 0.001 0.001
Echinococcus multilocularis neutral alpha glucosidase AB 0.1468 0.1548 0.1657
Schistosoma mansoni alpha-amylase 0.0123 0.0083 0.0078
Loa Loa (eye worm) trehalase 0.0136 0.0097 0.0097
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.1468 0.1548 1
Onchocerca volvulus 0.0136 0.0097 0.0093
Onchocerca volvulus 0.0136 0.0097 0.0093
Brugia malayi hypothetical protein 0.0133 0.0094 0.0094

Activities

No activities found for this compound.

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

No literature references available for this target.

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