Detailed information for compound 1824659

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 343.761 | Formula: C18H14ClNO4
  • H donors: 1 H acceptors: 2 LogP: 2.9 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(=O)Nc1cc(=O)oc2c1ccc(c2)OCc1cccc(c1)Cl
  • InChi: 1S/C18H14ClNO4/c1-11(21)20-16-9-18(22)24-17-8-14(5-6-15(16)17)23-10-12-3-2-4-13(19)7-12/h2-9H,10H2,1H3,(H,20,21)
  • InChiKey: IAJJQWGFMVPJSM-UHFFFAOYSA-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
Rattus norvegicus Monoamine oxidase B Starlite/ChEMBL References
Rattus norvegicus Monoamine oxidase A Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH Get druggable targets OG5_130722 All targets in OG5_130722
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH Get druggable targets OG5_130722 All targets in OG5_130722
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) Get druggable targets OG5_130722 All targets in OG5_130722
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Onchocerca volvulus Mitochondrial fission process protein 1 homolog Monoamine oxidase B   520 aa 469 aa 22.0 %
Dictyostelium discoideum hypothetical protein Monoamine oxidase B   520 aa 531 aa 23.2 %
Dictyostelium discoideum hypothetical protein Monoamine oxidase B   520 aa 538 aa 21.0 %
Dictyostelium discoideum amine oxidase Monoamine oxidase B   520 aa 489 aa 29.0 %
Brugia malayi amine oxidase, flavin-containing family protein Monoamine oxidase B   520 aa 479 aa 21.7 %
Dictyostelium discoideum hypothetical protein Monoamine oxidase B   520 aa 539 aa 22.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Beta-glucuronidase precursor 0.0167 0.0306 0.0272
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.102 0.2204 1
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0094 0.0142 0.0145
Loa Loa (eye worm) hypothetical protein 0.0051 0.0047 0.0041
Toxoplasma gondii melibiase subfamily protein 0.0264 0.0523 0.2218
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0094 0.0142 0.0145
Mycobacterium leprae PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO) 0.0051 0.0047 0.5
Echinococcus granulosus lysosomal alpha glucosidase 0.4523 1 1
Loa Loa (eye worm) trehalase 0.013 0.0224 0.0218
Loa Loa (eye worm) hypothetical protein 0.023 0.0446 0.0441
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.102 0.2204 1
Entamoeba histolytica glycogen phosphorylase, putative 0.0156 0.0282 0.1217
Loa Loa (eye worm) hypothetical protein 0.0085 0.0123 0.0118
Trypanosoma cruzi hypothetical protein, conserved 0.102 0.2204 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0509 0.1067 0.1036
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.023 0.0446 0.0496
Trichomonas vaginalis alpha-glucosidase, putative 0.102 0.2204 0.2327
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.4523 1 1
Onchocerca volvulus 0.013 0.0224 0.0267
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.4277 0.9452 0.945
Onchocerca volvulus Trehalase homolog 0.013 0.0224 0.0267
Loa Loa (eye worm) glycosyl hydrolase family 2 0.0181 0.0337 0.0332
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0094 0.0142 0.0145
Schistosoma mansoni ceramide glucosyltransferase 0.1412 0.3077 0.3421
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.0083 0.0119 0.012
Brugia malayi Glycosyl hydrolases family 2, sugar binding domain containing protein 0.0181 0.0337 0.0303
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0509 0.1067 0.1542
Echinococcus granulosus glycogen phosphorylase 0.0361 0.0738 0.0738
Loa Loa (eye worm) hypothetical protein 0.0509 0.1067 0.1062
Leishmania major glycosyl hydrolase-like protein 0.0509 0.1067 0.4737
Schistosoma mansoni bile acid beta-glucosidase-related 0.0815 0.1747 0.1942
Mycobacterium tuberculosis Possible conserved exported protein 0.0842 0.1809 1
Trypanosoma cruzi lysosomal alpha-mannosidase precursor, putative 0.0125 0.0212 0.0776
Brugia malayi Ceramide glucosyltransferase 0.1412 0.3077 0.3053
Trichomonas vaginalis glucosylceramidase, putative 0.2892 0.6369 0.6737
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0094 0.0142 0.0145
Schistosoma mansoni alpha-glucosidase 0.4072 0.8996 1
Loa Loa (eye worm) hypothetical protein 0.0094 0.0142 0.0137
Entamoeba histolytica beta-galactosidase, putative 0.0348 0.0709 0.3167
Echinococcus multilocularis mitogen activated protein kinase 0.0049 0.0044 0.0044
Trypanosoma brucei glucosidase, putative 0.102 0.2204 1
Onchocerca volvulus 0.0088 0.0131 0.0128
Brugia malayi RNA binding protein 0.0062 0.0071 0.0037
Echinococcus multilocularis bile acid beta glucosidase 0.0815 0.1747 0.1747
Echinococcus multilocularis tar DNA binding protein 0.0062 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.055 0.1158 0.1153
Brugia malayi Glycosyl hydrolases family 38 protein 0.014 0.0245 0.0211
Loa Loa (eye worm) RNA binding protein 0.0062 0.0071 0.0066
Mycobacterium ulcerans alpha-mannosidase 0.014 0.0245 0.1322
Trichomonas vaginalis conserved hypothetical protein 0.0195 0.0369 0.0385
Brugia malayi amine oxidase, flavin-containing family protein 0.0051 0.0047 0.0012
Schistosoma mansoni hypothetical protein 0.0397 0.0818 0.091
Schistosoma mansoni alpha-l-fucosidase 0.0649 0.1379 0.1532
Toxoplasma gondii Amylo-alpha-1,6-glucosidase 0.0381 0.0782 0.3416
Loa Loa (eye worm) glycosyl hydrolase family 38 protein 0.014 0.0245 0.024
Trichomonas vaginalis alpha-L-fucosidase, putative 0.0285 0.0568 0.0595
Entamoeba histolytica glycogen phosphorylase, putative 0.0361 0.0738 0.3301
Echinococcus multilocularis mannosyl oligosaccharide 1,2 alpha mannosidase 0.0094 0.0142 0.0142
Loa Loa (eye worm) hypothetical protein 0.013 0.0224 0.0218
Mycobacterium ulcerans glycogen phosphorylase GlgP 0.0156 0.0282 0.1534
Loa Loa (eye worm) hypothetical protein 0.1268 0.2755 0.2751
Echinococcus granulosus beta galactosidase 0.0962 0.2076 0.2076
Schistosoma mansoni bile acid beta-glucosidase-related 0.0815 0.1747 0.1942
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0094 0.0142 0.0145
Brugia malayi RNA recognition motif domain containing protein 0.0062 0.0071 0.0037
Echinococcus granulosus beta D xylosidase 2 0.0036 0.0015 0.0015
Loa Loa (eye worm) hypothetical protein 0.0051 0.0047 0.0041
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0094 0.0142 0.0145
Echinococcus multilocularis 0.0051 0.0047 0.0047
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.023 0.0446 0.0467
Echinococcus granulosus bile acid beta glucosidase 0.0815 0.1747 0.1747
Trichomonas vaginalis glucosylceramidase, putative 0.4277 0.9452 1
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0049 0.0044 0.0039
Loa Loa (eye worm) trehalase 0.013 0.0224 0.0218
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.023 0.0446 0.0496
Brugia malayi manba-prov protein 0.0167 0.0306 0.0272
Echinococcus granulosus lysosomal alpha mannosidase 0.0125 0.0212 0.0212
Loa Loa (eye worm) hypothetical protein 0.013 0.0224 0.0218
Trypanosoma cruzi hypothetical protein, conserved 0.102 0.2204 1
Trichomonas vaginalis alpha-glucosidase, putative 0.102 0.2204 0.2327
Trypanosoma cruzi UDP-galactopyranose mutase 0.0051 0.0047 0.0013
Trichomonas vaginalis glycoside hydrolases, putative 0.0402 0.083 0.0872
Trypanosoma cruzi UDP-galactopyranose mutase 0.0051 0.0047 0.0013
Brugia malayi Alpha-L-fucosidase family protein 0.0649 0.1379 0.1349
Onchocerca volvulus Ceramide glucosyltransferase homolog 0.1412 0.3077 0.4579
Onchocerca volvulus 0.3024 0.6664 1
Mycobacterium tuberculosis Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) 0.0667 0.1418 0.7782
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0071 0.0079
Schistosoma mansoni hypothetical protein 0.0488 0.1021 0.1135
Toxoplasma gondii histone lysine-specific demethylase 0.0051 0.0047 0.0013
Echinococcus granulosus mannosyl oligosaccharide 12 alpha mannosidase 0.0094 0.0142 0.0142
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0071 0.0079
Trichomonas vaginalis glycoside hydrolase, putative 0.0822 0.1764 0.1862
Brugia malayi Trehalase family protein 0.013 0.0224 0.019
Loa Loa (eye worm) alpha-L-fucosidase 0.0649 0.1379 0.1374
Trichomonas vaginalis glucosylceramidase, putative 0.4277 0.9452 1
Mycobacterium ulcerans dehydrogenase 0.0051 0.0047 0.0181
Loa Loa (eye worm) hypothetical protein 0.013 0.0224 0.0218
Echinococcus multilocularis neutral alpha glucosidase AB 0.102 0.2204 0.2204
Toxoplasma gondii histone lysine methyltransferase SET1 0.0053 0.0052 0.0037
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0094 0.0142 0.0145
Trichomonas vaginalis alpha-glucosidase, putative 0.0509 0.1067 0.1124
Schistosoma mansoni mannosidase alpha class 2a 0.0088 0.0131 0.0146
Trichomonas vaginalis glucosylceramidase, putative 0.2892 0.6369 0.6737
Brugia malayi SWIRM domain containing protein 0.0051 0.0047 0.0012
Trichomonas vaginalis conserved hypothetical protein 0.0094 0.0142 0.0145
Trichomonas vaginalis trehalase, putative 0.013 0.0224 0.0231
Brugia malayi hypothetical protein 0.013 0.0224 0.019
Loa Loa (eye worm) hypothetical protein 0.0045 0.0035 0.0029
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.102 0.2204 0.2327
Trichomonas vaginalis beta-mannosidase, putative 0.0167 0.0306 0.0318
Echinococcus granulosus lysine specific histone demethylase 1A 0.0051 0.0047 0.0047
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0051 0.0047 0.0047
Echinococcus granulosus mitogen activated protein kinase 3 0.0049 0.0044 0.0044
Trichomonas vaginalis conserved hypothetical protein 0.013 0.0224 0.0231
Brugia malayi Glycosyl hydrolases family 38 protein 0.0088 0.0131 0.0097
Brugia malayi Amylo-alpha-1,6-glucosidase family protein 0.0381 0.0782 0.075
Trichomonas vaginalis maltase-glucoamylase, putative 0.0509 0.1067 0.1124
Entamoeba histolytica glycogenphosphorylase, putative 0.0156 0.0282 0.1217
Echinococcus multilocularis glycogen phosphorylase 0.0361 0.0738 0.0738
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.0057 0.006 0.0067
Trichomonas vaginalis CMGC family protein kinase 0.0049 0.0044 0.0041
Echinococcus multilocularis protoporphyrinogen oxidase 0.0051 0.0047 0.0047
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0306 0.0615 1
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0071 0.0079
Trichomonas vaginalis glucosylceramidase, putative 0.2917 0.6426 0.6797
Trypanosoma brucei lysosomal alpha-mannosidase precursor, putative 0.0098 0.0152 0.0502
Mycobacterium tuberculosis Probable glycogen phosphorylase GlgP 0.0156 0.0282 0.1334
Loa Loa (eye worm) hypothetical protein 0.013 0.0224 0.0218
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0062 0.0071 0.0066
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0264 0.0523 0.0523
Schistosoma mansoni glycogen phosphorylase 0.0156 0.0282 0.0313
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0264 0.0523 0.0581
Echinococcus multilocularis Glycosyl transferase, family 35 0.0361 0.0738 0.0738
Echinococcus multilocularis beta D xylosidase 2 0.0036 0.0015 0.0015
Schistosoma mansoni beta-mannosidase 0.0167 0.0306 0.034
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0094 0.0142 0.0145
Trichomonas vaginalis glycogen phosphorylase, putative 0.0361 0.0738 0.0775
Loa Loa (eye worm) trehalase 0.0045 0.0035 0.0029
Toxoplasma gondii histone lysine-specific demethylase LSD1/BHC110/KDMA1A 0.0052 0.0051 0.0031
Entamoeba histolytica alpha-1,2-mannosidase, putative 0.0842 0.1809 0.8195
Loa Loa (eye worm) TRE-2 protein 0.013 0.0224 0.0218
Loa Loa (eye worm) hypothetical protein 0.0045 0.0035 0.0029
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.102 0.2204 0.2327
Brugia malayi Mannosyl-oligosaccharide alpha-1,2-mannosidase isoform 1 0.0094 0.0142 0.0108
Echinococcus multilocularis lysosomal alpha glucosidase 0.4523 1 1
Schistosoma mansoni hypothetical protein 0.0489 0.1024 0.1138
Trichomonas vaginalis alpha-glucosidase, putative 0.102 0.2204 0.2327
Echinococcus multilocularis transfer RNA-Trp 0.0094 0.0142 0.0142
Schistosoma mansoni amine oxidase 0.0051 0.0047 0.0052
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0264 0.0523 0.0581
Echinococcus granulosus lysine specific histone demethylase 1A 0.0051 0.0047 0.0047
Echinococcus multilocularis lysosomal alpha glucosidase 0.4523 1 1
Trichomonas vaginalis sucrase-isomaltase, putative 0.096 0.2071 0.2186
Onchocerca volvulus Glucosylceramidase homolog 0.2892 0.6369 0.9554
Loa Loa (eye worm) beta-glucuronidase 0.0167 0.0306 0.0301
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0509 0.1067 0.4737
Chlamydia trachomatis glycogen phosphorylase 0.0361 0.0738 1
Leishmania major alpha glucosidase II subunit, putative 0.102 0.2204 1
Leishmania major UDP-galactopyranose mutase 0.0051 0.0047 0.0013
Trichomonas vaginalis conserved hypothetical protein 0.0515 0.108 0.1138
Echinococcus multilocularis alpha mannosidase 2 0.0088 0.0131 0.0131
Loa Loa (eye worm) hypothetical protein 0.0094 0.0142 0.0137
Schistosoma mansoni Protoporphyrinogen oxidase chloroplast/mitochondrial precursor 0.0051 0.0047 0.0052
Schistosoma mansoni alpha glucosidase 0.102 0.2204 0.245
Onchocerca volvulus 0.013 0.0224 0.0267
Echinococcus multilocularis beta galactosidase 0.0962 0.2076 0.2076
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0094 0.0142 0.0145
Loa Loa (eye worm) hypothetical protein 0.0093 0.0141 0.0135
Trypanosoma cruzi lysosomal alpha-mannosidase precursor, putative 0.0125 0.0212 0.0776
Schistosoma mansoni beta-galactosidase 0.0962 0.2076 0.2307
Loa Loa (eye worm) hypothetical protein 0.0088 0.0131 0.0126
Loa Loa (eye worm) hypothetical protein 0.0962 0.2076 0.2071
Loa Loa (eye worm) TAR-binding protein 0.0062 0.0071 0.0066
Echinococcus granulosus glycogen debranching enzyme 0.0381 0.0782 0.0782
Trichomonas vaginalis alpha-L-fucosidase, putative 0.0285 0.0568 0.0595
Echinococcus granulosus Glycosyl transferase family 35 0.0361 0.0738 0.0738
Schistosoma mansoni amine oxidase 0.0051 0.0047 0.0052
Trichomonas vaginalis beta-glucosidase, putative 0.0402 0.083 0.0872
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0264 0.0523 0.0523
Loa Loa (eye worm) hypothetical protein 0.0045 0.0035 0.0029
Loa Loa (eye worm) mannosidase 0.0094 0.0142 0.0137
Brugia malayi TAR-binding protein 0.0062 0.0071 0.0037
Trichomonas vaginalis alpha-glucosidase, putative 0.0509 0.1067 0.1124
Trichomonas vaginalis alpha-glucosidase, putative 0.0509 0.1067 0.1124
Echinococcus multilocularis ceramide glucosyltransferase 0.1412 0.3077 0.3077
Loa Loa (eye worm) ceramide glucosyltransferase 0.1412 0.3077 0.3074
Loa Loa (eye worm) hypothetical protein 0.0051 0.0047 0.0041
Loa Loa (eye worm) hypothetical protein 0.0081 0.0114 0.0108
Brugia malayi Glycosyl hydrolases family 38 protein 0.0088 0.0131 0.0097
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0094 0.0142 0.0145
Brugia malayi Trehalase family protein 0.013 0.0224 0.019
Echinococcus multilocularis glycogen debranching enzyme 0.0381 0.0782 0.0782
Onchocerca volvulus 0.013 0.0224 0.0267
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.102 0.2204 0.22
Brugia malayi Melibiase family protein 0.023 0.0446 0.0413
Trichomonas vaginalis glycogen phosphorylase, putative 0.0361 0.0738 0.0775
Trichomonas vaginalis glucosylceramidase, putative 0.2892 0.6369 0.6737
Loa Loa (eye worm) amylo-alpha-1,6-glucosidase 0.0185 0.0347 0.0342
Brugia malayi hypothetical protein 0.0051 0.0047 0.0012
Schistosoma mansoni serine/threonine protein kinase 0.0049 0.0044 0.0049
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0094 0.0142 0.0145
Loa Loa (eye worm) hypothetical protein 0.0051 0.0047 0.0041
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0264 0.0523 0.0581
Brugia malayi Trehalase family protein 0.013 0.0224 0.019
Trichomonas vaginalis CMGC family protein kinase 0.0049 0.0044 0.0041
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0094 0.0142 0.0145
Trypanosoma brucei lysosomal alpha-mannosidase precursor, putative 0.0125 0.0212 0.0776
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.0125 0.0212 0.0235
Mycobacterium ulcerans oxidoreductase 0.0051 0.0047 0.0181
Trichomonas vaginalis alpha-glucosidase, putative 0.102 0.2204 0.2327
Schistosoma mansoni mannosyl-oligosaccharide alpha-12-mannosidase 0.0094 0.0142 0.0158
Mycobacterium ulcerans protoporphyrinogen oxidase 0.0051 0.0047 0.0181
Trichomonas vaginalis alpha-glucosidase, putative 0.0509 0.1067 0.1124
Onchocerca volvulus 0.013 0.0224 0.0267
Treponema pallidum hypothetical protein 0.0045 0.0035 0.5
Trichomonas vaginalis CMGC family protein kinase 0.0049 0.0044 0.0041
Trichomonas vaginalis glucosylceramidase, putative 0.2892 0.6369 0.6737
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0717 0.153 0.8725
Loa Loa (eye worm) hypothetical protein 0.0088 0.0131 0.0126
Schistosoma mansoni ceramide glucosyltransferase 0.1412 0.3077 0.3421
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0509 0.1067 0.4737
Echinococcus multilocularis mitogen activated protein kinase 3 0.0049 0.0044 0.0044
Schistosoma mansoni hypothetical protein 0.0036 0.0015 0.0017
Trichomonas vaginalis glucosylceramidase, putative 0.4277 0.9452 1
Loa Loa (eye worm) hypothetical protein 0.013 0.0224 0.0218
Loa Loa (eye worm) trehalase 0.013 0.0224 0.0218
Loa Loa (eye worm) glycogen phosphorylase 0.0361 0.0738 0.0733
Schistosoma mansoni alpha-glucosidase 0.4072 0.8996 1
Echinococcus granulosus neutral alpha glucosidase AB 0.102 0.2204 0.2204
Trichomonas vaginalis beta-galactosidase, putative 0.0515 0.108 0.1138
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0094 0.0142 0.0145
Trichomonas vaginalis alpha-glucosidase, putative 0.102 0.2204 0.2327
Loa Loa (eye worm) hypothetical protein 0.0381 0.0782 0.0777
Onchocerca volvulus Glycogen phosphorylase homolog 0.0361 0.0738 0.1044
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0509 0.1067 0.4805
Echinococcus granulosus alpha mannosidase 2 0.0032 0.0005 0.0005
Mycobacterium ulcerans alpha-L-fucosidase 0.0817 0.1752 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.0047 0.0041
Entamoeba histolytica glycogen debranching enzyme, putative 0.0381 0.0782 0.3501
Echinococcus multilocularis fucosidase, alpha L 1, tissue 0.0817 0.1752 0.1752
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.0078 0.0107 0.0108
Loa Loa (eye worm) TRE-1 protein 0.013 0.0224 0.0218
Trichomonas vaginalis glucosylceramidase, putative 0.4277 0.9452 1
Schistosoma mansoni glycogen phosphorylase 0.0361 0.0738 0.082
Entamoeba histolytica glycogen phosphorylase, putative 0.0156 0.0282 0.1217
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.4277 0.9452 0.9451
Giardia lamblia Glycogen phosphorylase 0.0361 0.0738 0.5276
Echinococcus multilocularis non lysosomal glucosylceramidase 0.0815 0.1747 0.1747
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.096 0.2071 0.9392
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0071 0.0079
Schistosoma mansoni hypothetical protein 0.0275 0.0546 0.0607
Echinococcus multilocularis dnaJ subfamily B 0.0397 0.0818 0.0818
Mycobacterium ulcerans flavin-containing monoamine oxidase AofH 0.0717 0.153 0.8725
Trichomonas vaginalis glycogen debranching enzyme, putative 0.0381 0.0782 0.0822
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0509 0.1067 0.1124
Trichomonas vaginalis alpha-mannosidase, putative 0.014 0.0245 0.0254
Onchocerca volvulus 0.013 0.0224 0.0267
Echinococcus granulosus glycogen phosphorylase 0.0361 0.0738 0.0738
Trichomonas vaginalis glucosylceramidase, putative 0.4277 0.9452 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.102 0.2204 0.2177
Mycobacterium ulcerans monoamine oxidase 0.0051 0.0047 0.0181
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0051 0.0047 0.0052
Echinococcus multilocularis endoplasmic reticulum mannosyl oligosaccharide 0.0094 0.0142 0.0142
Trichomonas vaginalis glucosylceramidase, putative 0.2892 0.6369 0.6737
Echinococcus granulosus non lysosomal glucosylceramidase 0.0815 0.1747 0.1747
Schistosoma mansoni glycogen phosphorylase 0.0361 0.0738 0.082
Loa Loa (eye worm) hypothetical protein 0.0045 0.0035 0.0029
Echinococcus granulosus fucosidase alpha L 1 tissue 0.0817 0.1752 0.1752
Brugia malayi carbohydrate phosphorylase 0.0361 0.0738 0.0706
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.0088 0.0131 0.0146
Plasmodium vivax hypothetical protein, conserved 0.0306 0.0615 1
Onchocerca volvulus 0.0088 0.0131 0.0128
Trichomonas vaginalis glycogen debranching enzyme, putative 0.0381 0.0782 0.0822
Echinococcus granulosus dnaJ subfamily B 0.0397 0.0818 0.0818
Trichomonas vaginalis CMGC family protein kinase 0.0049 0.0044 0.0041
Trypanosoma brucei glycosyl hydrolase-like protein 0.0509 0.1067 0.4737
Trichomonas vaginalis glucosylceramidase, putative 0.4277 0.9452 1
Echinococcus multilocularis glycogen phosphorylase 0.0361 0.0738 0.0738
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0059 0.0066 0.0073
Loa Loa (eye worm) hypothetical protein 0.0057 0.006 0.0055
Echinococcus granulosus tar DNA binding protein 0.0062 0.0071 0.0071
Loa Loa (eye worm) hypothetical protein 0.0051 0.0047 0.0041
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.014 0.0245 0.0254
Brugia malayi Trehalase family protein 0.013 0.0224 0.019
Echinococcus granulosus mitogen activated protein kinase 0.0049 0.0044 0.0044
Echinococcus granulosus ceramide glucosyltransferase 0.1412 0.3077 0.3077
Trichomonas vaginalis glucosylceramidase, putative 0.2892 0.6369 0.6737
Giardia lamblia 4-alpha-glucanotransferase, amylo-alpha-1,6-glucosidase 0.0381 0.0782 0.5609
Giardia lamblia Ceramide glucosyltransferase 0.064 0.1359 1
Trichomonas vaginalis maltase-glucoamylase, putative 0.102 0.2204 0.2327
Echinococcus multilocularis lysosomal alpha mannosidase 0.0125 0.0212 0.0212
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0264 0.0523 0.0581
Trichomonas vaginalis glucosylceramidase, putative 0.2917 0.6426 0.6797
Schistosoma mansoni tar DNA-binding protein 0.0062 0.0071 0.0079
Trichomonas vaginalis glucosylceramidase, putative 0.2892 0.6369 0.6737
Trichomonas vaginalis alpha-glucosidase, putative 0.0509 0.1067 0.1124
Brugia malayi MAP kinase sur-1 0.0049 0.0044 0.0009
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0509 0.1067 0.1124
Brugia malayi lysosomal alpha-mannosidase 0.0088 0.0131 0.0097
Loa Loa (eye worm) trehalase 0.0045 0.0035 0.0029
Brugia malayi hypothetical protein 0.0085 0.0125 0.009
Trichomonas vaginalis Periplasmic beta-glucosidase precursor, putative 0.0036 0.0015 0.0011
Entamoeba histolytica glycogen phosphorylase, putative 0.0361 0.0738 0.3301
Echinococcus granulosus endoplasmic reticulum mannosyl oligosaccharide 0.0094 0.0142 0.0142
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0264 0.0523 0.0523

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 6.55 Inhibition of Sprague-Dawley rat MAO-A using Kynuramine as substrate assessed as formation of 4-hydroxyquinoline preincubated for 5 mins prior to substrate addition measured for 5 mins by spectrophotometry ChEMBL. 24231308
IC50 (binding) = 7.41 Inhibition of Sprague-Dawley rat MAO-B using Kynuramine as substrate assessed as formation of 4-hydroxyquinoline preincubated for 5 mins prior to substrate addition measured for 5 mins by spectrophotometry ChEMBL. 24231308
IC50 (binding) = 7.41 Inhibition of Sprague-Dawley rat MAO-B in brain mitochondrial homogenate assessed as 4-hydroxyquinoline by spectrophotometric method ChEMBL. 25462230

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

No literature references available for this target.

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