Detailed information for compound 114614

Basic information

Technical information
  • TDR Targets ID: 114614
  • Name: 4-[(3,4-diethylphenyl)carbamoyl]benzoic acid
  • MW: 297.348 | Formula: C18H19NO3
  • H donors: 2 H acceptors: 3 LogP: 3.88 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1ccc(cc1CC)NC(=O)c1ccc(cc1)C(=O)O
  • InChi: 1S/C18H19NO3/c1-3-12-9-10-16(11-13(12)4-2)19-17(20)14-5-7-15(8-6-14)18(21)22/h5-11H,3-4H2,1-2H3,(H,19,20)(H,21,22)
  • InChiKey: XUEQPMJWWJNFPY-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-[(3,4-diethylanilino)-oxomethyl]benzoic acid
  • 4-[[(3,4-diethylphenyl)amino]-oxomethyl]benzoic acid

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
Echinococcus granulosus glucan 14 alpha branching enzyme 1 0.0038 0.0023 0.0022
Mycobacterium leprae Putative uncharacterized protein ML2045 0.0158 0.0338 1
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0006 0.0005
Echinococcus granulosus beta galactosidase 0.0916 0.2324 0.2323
Loa Loa (eye worm) hypothetical protein 0.007 0.0108 0.0108
Entamoeba histolytica hypothetical protein 0.0044 0.0039 0.0151
Echinococcus multilocularis mannosyl oligosaccharide 1,2 alpha mannosidase 0.0147 0.031 0.0306
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0473 0.1164 0.1312
Brugia malayi CHE-14 protein 0.0051 0.0059 0.0059
Trichomonas vaginalis maltase-glucoamylase, putative 0.1018 0.259 0.9818
Loa Loa (eye worm) hypothetical protein 0.0066 0.0099 0.0099
Loa Loa (eye worm) hypothetical protein 0.0061 0.0083 0.0083
Loa Loa (eye worm) manba-prov protein 0.0164 0.0353 0.0353
Entamoeba histolytica glycogen debranching enzyme, putative 0.0557 0.1383 0.5339
Giardia lamblia Hypothetical protein 0.0051 0.0058 0.021
Loa Loa (eye worm) hypothetical protein 0.0124 0.025 0.025
Trichomonas vaginalis beta-mannosidase, putative 0.0219 0.0499 0.1818
Echinococcus granulosus lysosomal alpha glucosidase 0.3848 1 1
Brugia malayi 1,4-alpha-glucan branching enzyme 0.0038 0.0023 0.0023
Schistosoma mansoni hypothetical protein 0.0038 0.0023 0.0025
Leishmania major inosine-guanine nucleoside hydrolase, putative 0.0051 0.0058 0.0224
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0986 0.2506 0.2503
Entamoeba histolytica glycogen phosphorylase, putative 0.0668 0.1673 0.646
Trichomonas vaginalis glucosylceramidase, putative 0.0526 0.1301 0.4889
Brugia malayi hypothetical protein 0.0149 0.0314 0.0314
Mycobacterium tuberculosis Trehalose synthase TreS 0.0158 0.0338 0.1047
Echinococcus multilocularis glycogen debranching enzyme 0.0557 0.1383 0.138
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.028 0.0658 0.2027
Mycobacterium ulcerans glycosidase 0.0038 0.0023 0.0051
Schistosoma mansoni alpha-amylase 0.0158 0.0338 0.0381
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0099 0.0288
Brugia malayi Amylo-alpha-1,6-glucosidase family protein 0.0557 0.1383 0.1383
Trichomonas vaginalis glucosylceramidase, putative 0.0526 0.1301 0.4889
Toxoplasma gondii 1,4-alpha-glucan-branching enzyme 0.0038 0.0023 0.0078
Brugia malayi Trehalase family protein 0.0429 0.1049 0.1049
Brugia malayi Glycosyl hydrolases family 31 protein 0.1018 0.259 0.259
Echinococcus multilocularis alpha mannosidase 2 0.0194 0.0434 0.043
Entamoeba histolytica alpha-amylase, putative 0.0038 0.0023 0.0091
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0147 0.031 0.1095
Trichomonas vaginalis glucosylceramidase, putative 0.0526 0.1301 0.4889
Onchocerca volvulus 0.0059 0.0078 0.0103
Schistosoma mansoni alpha-amylase 0.0158 0.0338 0.0381
Leishmania major alpha glucosidase II subunit, putative 0.1018 0.259 1
Onchocerca volvulus 0.0429 0.1049 0.1382
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0006 0.0005
Loa Loa (eye worm) glycosyl hydrolase family 38 protein 0.0366 0.0882 0.0882
Echinococcus granulosus alpha mannosidase 2 0.007 0.0108 0.0107
Entamoeba histolytica glycogen phosphorylase, putative 0.0668 0.1673 0.646
Loa Loa (eye worm) alpha amylase 0.0158 0.0338 0.0338
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0147 0.031 0.1095
Schistosoma mansoni hypothetical protein 0.0415 0.1012 0.114
Echinococcus multilocularis sterol regulatory element binding protein 0.0051 0.0059 0.0056
Echinococcus multilocularis Glycosyl transferase, family 35 0.0668 0.1673 0.167
Loa Loa (eye worm) TRE-1 protein 0.0429 0.1049 0.1049
Trichomonas vaginalis conserved hypothetical protein 0.0051 0.0059 0.0136
Brugia malayi Glycosyl hydrolases family 38 protein 0.0366 0.0882 0.0882
Loa Loa (eye worm) hypothetical protein 0.0557 0.1383 0.1383
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0033 0.0033
Entamoeba histolytica alpha-amylase, putative 0.0038 0.0023 0.0091
Brugia malayi Trehalase family protein 0.0149 0.0314 0.0314
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative 0.0051 0.0058 0.0133
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.04 0.0972 0.1095
Echinococcus granulosus lysosomal alpha mannosidase 0.0232 0.0533 0.0531
Schistosoma mansoni bile acid beta-glucosidase-related 0.0442 0.1083 0.122
Loa Loa (eye worm) glycosyl hydrolase family 2 0.0306 0.0725 0.0725
Trichomonas vaginalis glucosylceramidase, putative 0.0526 0.1301 0.4889
Schistosoma mansoni cpg binding protein 0.0031 0.0005 0.0005
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.1263 0.3232 0.5
Schistosoma mansoni thyroid hormone receptor 0.0164 0.0355 0.0399
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative 0.0051 0.0058 0.0133
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0072 0.0266
Onchocerca volvulus 0.0429 0.1049 0.1382
Echinococcus multilocularis dnaJ subfamily B 0.0415 0.1012 0.1009
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0147 0.031 0.1095
Echinococcus multilocularis beta galactosidase 0.0916 0.2324 0.2321
Loa Loa (eye worm) trehalase 0.0429 0.1049 0.1049
Trypanosoma cruzi lysosomal alpha-mannosidase precursor, putative 0.0232 0.0533 0.1874
Onchocerca volvulus Phosphorylase b kinase regulatory subunit beta homolog 0.0066 0.0099 0.013
Leishmania major nonspecific nucleoside hydrolase 0.0051 0.0058 0.0224
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.1263 0.3232 0.7069
Onchocerca volvulus 0.2927 0.759 1
Entamoeba histolytica alpha-amylase family protein 0.0038 0.0023 0.0091
Trichomonas vaginalis glucosylceramidase, putative 0.0801 0.2023 0.7649
Brugia malayi hypothetical protein 0.0149 0.0314 0.0314
Schistosoma mansoni glycogen phosphorylase 0.0668 0.1673 0.1885
Echinococcus granulosus fucosidase alpha L 1 tissue 0.1775 0.4572 0.4571
Loa Loa (eye worm) hypothetical protein 0.0299 0.0706 0.0706
Trypanosoma brucei lysosomal alpha-mannosidase precursor, putative 0.0232 0.0533 0.2046
Loa Loa (eye worm) hypothetical protein 0.0038 0.0023 0.0023
Echinococcus granulosus Protein patched homolog 1 0.0051 0.0059 0.0058
Trichomonas vaginalis glucosylceramidase, putative 0.0801 0.2023 0.7649
Loa Loa (eye worm) trehalase 0.0429 0.1049 0.1049
Schistosoma mansoni transcription factor LCR-F1 0.0044 0.0039 0.0043
Onchocerca volvulus Putative phosphorylase b kinase regulatory subunit alpha 0.0066 0.0099 0.013
Mycobacterium ulcerans trehalose synthase TreS 0.0158 0.0338 0.074
Trichomonas vaginalis alpha-L-fucosidase, putative 0.0613 0.153 0.5765
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.0232 0.0533 0.0599
Schistosoma mansoni importin beta-1 0.003 0.0003 0.0003
Brugia malayi hypothetical protein 0.0066 0.0099 0.0099
Echinococcus multilocularis alpha glucosidase 0.0158 0.0338 0.0335
Loa Loa (eye worm) hypothetical protein 0.0916 0.2324 0.2324
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0493 0.1216 0.4572
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0093 0.0104
Onchocerca volvulus 0.0194 0.0434 0.0571
Entamoeba histolytica alpha-1,2-mannosidase, putative 0.0881 0.2233 0.8622
Brugia malayi trehalase I 0.0149 0.0314 0.0314
Schistosoma mansoni alpha glucosidase 0.1018 0.259 0.2919
Brugia malayi RNA binding protein 0.0064 0.0093 0.0093
Schistosoma mansoni hypothetical protein 0.0402 0.0978 0.1101
Brugia malayi phosphorylase B kinase alpha regulatory chain 0.0066 0.0099 0.0099
Mycobacterium tuberculosis Probable nucleoside hydrolase IunH (purine nucleosidase) 0.0051 0.0058 0.018
Trichomonas vaginalis glycogen phosphorylase, putative 0.0668 0.1673 0.631
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0147 0.031 0.1095
Giardia lamblia Glycogen phosphorylase 0.0668 0.1673 1
Schistosoma mansoni hypothetical protein 0.0059 0.0078 0.0087
Echinococcus granulosus bile acid beta glucosidase 0.0442 0.1083 0.1082
Loa Loa (eye worm) hypothetical protein 0.04 0.0972 0.0972
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0147 0.031 0.1095
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.0006 0.0002
Mycobacterium ulcerans maltooligosyltrehalose synthase TreX 0.0038 0.0023 0.0051
Mycobacterium tuberculosis Probable alpha-glucosidase AglA (maltase) (glucoinvertase) (glucosidosucrase) (maltase-glucoamylase) (lysosomal alpha-glucosidas 0.0158 0.0338 0.1047
Plasmodium vivax SET domain protein, putative 0.0031 0.0006 0.0007
Trichomonas vaginalis alpha-glucosidase, putative 0.0493 0.1216 0.4561
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0001 0.0001
Trichomonas vaginalis alpha-glucosidase, putative 0.1018 0.259 0.9818
Mycobacterium ulcerans alpha-mannosidase 0.0366 0.0882 0.1929
Onchocerca volvulus Uncharacterized family 31 glucosidase KIAA1161 homolog 0.0493 0.1216 0.1602
Schistosoma mansoni patched 1 0.0051 0.0059 0.0066
Mycobacterium tuberculosis Probable glycogen phosphorylase GlgP 0.0289 0.068 0.2106
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.1018 0.259 1
Brugia malayi Alpha amylase, catalytic domain containing protein 0.0158 0.0338 0.0338
Onchocerca volvulus 0.0031 0.0006 0.0008
Echinococcus granulosus snurportin 1 0.0321 0.0766 0.0765
Brugia malayi Glycosyl hydrolases family 38 protein 0.0194 0.0434 0.0434
Loa Loa (eye worm) hypothetical protein 0.0149 0.0314 0.0314
Schistosoma mansoni niemann-pick C1 (NPC1) 0.0122 0.0243 0.0273
Loa Loa (eye worm) hypothetical protein 0.007 0.0108 0.0108
Entamoeba histolytica fatty acid elongase, putative 0.0164 0.0354 0.1367
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.1263 0.3232 0.7069
Echinococcus granulosus alpha mannosidase 2 0.0058 0.0077 0.0076
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0044 0.0039 0.0036
Loa Loa (eye worm) hypothetical protein 0.0066 0.0099 0.0099
Schistosoma mansoni thyroid hormone receptor 0.0164 0.0355 0.0399
Schistosoma mansoni alpha-amylase 0.0158 0.0338 0.0381
Trichomonas vaginalis set domain proteins, putative 0.0242 0.0557 0.2041
Brugia malayi Glycosyl hydrolases family 31 protein 0.0493 0.1216 0.1216
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.3848 1 1
Echinococcus granulosus endoplasmic reticulum mannosyl oligosaccharide 0.0147 0.031 0.0309
Loa Loa (eye worm) hypothetical protein 0.0162 0.0349 0.0349
Schistosoma mansoni cpg binding protein 0.0031 0.0005 0.0005
Onchocerca volvulus 0.0429 0.1049 0.1382
Schistosoma mansoni bile acid beta-glucosidase-related 0.0442 0.1083 0.122
Toxoplasma gondii Alpha-galactosidase 0.0031 0.0006 0.0011
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0147 0.031 0.1095
Trichomonas vaginalis alpha-glucosidase, putative 0.0493 0.1216 0.4561
Echinococcus granulosus Niemann Pick C1 protein 0.012 0.0238 0.0237
Mycobacterium ulcerans glycogen phosphorylase GlgP 0.0289 0.068 0.1488
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0147 0.031 0.1095
Loa Loa (eye worm) myosin heavy chain 0.0066 0.0099 0.0099
Entamoeba histolytica fatty acid elongase, putative 0.0164 0.0354 0.1367
Schistosoma mansoni beta-mannosidase 0.0219 0.0499 0.0561
Echinococcus granulosus survival motor neuron protein 1 0.0287 0.0677 0.0676
Chlamydia trachomatis oxoacyl-ACP synthase III 0.1263 0.3232 1
Echinococcus multilocularis protein patched 0.0051 0.0059 0.0056
Schistosoma mansoni hypothetical protein 0.0041 0.0033 0.0036
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0006 0.0005
Schistosoma mansoni mannosyl-oligosaccharide alpha-12-mannosidase 0.0147 0.031 0.0348
Echinococcus multilocularis neutral alpha glucosidase AB 0.1018 0.259 0.2587
Trypanosoma cruzi inosine-adenosine-guanosine-nucleosidehydrolase, putative 0.0444 0.1088 0.4066
Entamoeba histolytica alpha-amylase family protein 0.0038 0.0023 0.0091
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0473 0.1164 0.1312
Trichomonas vaginalis maltase-glucoamylase, putative 0.0493 0.1216 0.4561
Onchocerca volvulus Trehalase homolog 0.0429 0.1049 0.1382
Echinococcus granulosus cpg binding protein 0.0031 0.0005 0.0004
Echinococcus granulosus dnaJ subfamily B 0.0415 0.1012 0.1011
Echinococcus granulosus alpha glucosidase 0.0158 0.0338 0.0337
Entamoeba histolytica 1,4-alpha-glucan branching enzyme, putative 0.0038 0.0023 0.0091
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0147 0.031 0.1095
Echinococcus multilocularis trehalose 6 phosphate hydrolase 0.0038 0.0023 0.002
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0006 0.0005
Loa Loa (eye worm) hypothetical protein 0.007 0.0108 0.0108
Trichomonas vaginalis glucosylceramidase, putative 0.0526 0.1301 0.4889
Leishmania major glycosyl hydrolase-like protein 0.0493 0.1216 0.4694
Toxoplasma gondii Amylo-alpha-1,6-glucosidase 0.0557 0.1383 0.5333
Mycobacterium tuberculosis Possible conserved exported protein 0.0881 0.2233 0.6909
Loa Loa (eye worm) amylo-alpha-1,6-glucosidase 0.0271 0.0634 0.0634
Schistosoma mansoni alpha-glucosidase 0.3416 0.887 1
Schistosoma mansoni mannosidase alpha class 2a 0.0194 0.0434 0.0488
Echinococcus granulosus glycogen phosphorylase 0.0668 0.1673 0.1672
Onchocerca volvulus 0.0429 0.1049 0.1382
Loa Loa (eye worm) hypothetical protein 0.0287 0.0677 0.0677
Entamoeba histolytica glycogen phosphorylase, putative 0.0289 0.068 0.2628
Trichomonas vaginalis hypothetical protein 0.0051 0.0058 0.0133
Loa Loa (eye worm) hypothetical protein 0.012 0.0238 0.0238
Mycobacterium ulcerans beta-ketoacyl synthase-like protein 0.1263 0.3232 0.7069
Entamoeba histolytica Niemann-Pick C1 protein, putative 0.012 0.0238 0.0919
Echinococcus granulosus neutral alpha glucosidase AB 0.1018 0.259 0.2589
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0031 0.0006 0.0009
Loa Loa (eye worm) alpha-L-fucosidase 0.1398 0.3585 0.3585
Brugia malayi Trehalase family protein 0.0429 0.1049 0.1049
Brugia malayi carbohydrate phosphorylase 0.0668 0.1673 0.1673
Trichomonas vaginalis conserved hypothetical protein 0.0286 0.0673 0.2484
Schistosoma mansoni hypothetical protein 0.005 0.0054 0.006
Brugia malayi lysosomal alpha-mannosidase 0.0194 0.0434 0.0434
Brugia malayi Trehalase family protein 0.0429 0.1049 0.1049
Trichomonas vaginalis beta-glucosidase, putative 0.1036 0.2637 1
Toxoplasma gondii alpha amylase, catalytic domain-containing protein 0.0038 0.0023 0.0078
Schistosoma mansoni phosphorylase B kinase beta kpbb 0.0066 0.0099 0.011
Leishmania major inosine-adenosine-guanosine-nucleoside hydrolase, putative 0.0444 0.1088 0.4199
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.0366 0.0882 0.3284
Echinococcus multilocularis lysosomal alpha glucosidase 0.3848 1 1
Entamoeba histolytica beta-galactosidase, putative 0.0361 0.087 0.3358
Loa Loa (eye worm) glycogen phosphorylase 0.0668 0.1673 0.1673
Schistosoma mansoni survival motor neuron protein 0.0059 0.0078 0.0087
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.04 0.0972 0.1095
Trichomonas vaginalis glucosylceramidase, putative 0.0554 0.1375 0.5172
Mycobacterium ulcerans maltooligosyltrehalose trehalohydrolase, TreZ 0.0038 0.0023 0.0051
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0031 0.0006 0.0006
Entamoeba histolytica hypothetical protein 0.0044 0.0039 0.0151
Schistosoma mansoni hypothetical protein 0.005 0.0054 0.006
Echinococcus multilocularis snurportin 1 0.0321 0.0766 0.0763
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0321 0.0766 0.0766
Schistosoma mansoni hypothetical protein 0.0408 0.0992 0.1117
Brugia malayi Mannosyl-oligosaccharide alpha-1,2-mannosidase isoform 1 0.0147 0.031 0.031
Entamoeba histolytica glycogen phosphorylase, putative 0.0289 0.068 0.2628
Trypanosoma cruzi inosine-adenosine-guanosine-nucleosidehydrolase, putative 0.0444 0.1088 0.4066
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0473 0.1164 0.1161
Echinococcus multilocularis phosphorylase b kinase regulatory 0.0066 0.0099 0.0095
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.1018 0.259 0.9818
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0147 0.031 0.1095
Schistosoma mansoni hypothetical protein 0.0716 0.1799 0.2027
Trichomonas vaginalis conserved hypothetical protein 0.0643 0.1608 0.6063
Loa Loa (eye worm) trehalase 0.0149 0.0314 0.0314
Trichomonas vaginalis alpha-L-fucosidase, putative 0.0613 0.153 0.5765
Brugia malayi Trehalase protein 5 0.0149 0.0314 0.0314
Brugia malayi manba-prov protein 0.0446 0.1092 0.1092
Brugia malayi hypothetical protein 0.0149 0.0314 0.0314
Echinococcus granulosus phosphorylase b kinase regulatory 0.0066 0.0099 0.0098
Trichomonas vaginalis beta-galactosidase, putative 0.0643 0.1608 0.6063
Mycobacterium tuberculosis Conserved protein 0.0066 0.0099 0.0305
Trichomonas vaginalis alpha-glucosidase, putative 0.0493 0.1216 0.4561
Loa Loa (eye worm) hypothetical protein 0.0194 0.0434 0.0434
Echinococcus granulosus beta mannosidase 0.0164 0.0353 0.0352
Mycobacterium tuberculosis Maltooligosyltrehalose synthase TreY 0.0038 0.0023 0.0073
Trypanosoma brucei glucosidase, putative 0.1018 0.259 1
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0473 0.1164 0.1163
Trichomonas vaginalis alpha-glucosidase, putative 0.1018 0.259 0.9818
Loa Loa (eye worm) trehalase 0.0429 0.1049 0.1049
Echinococcus multilocularis transfer RNA-Trp 0.0147 0.031 0.0306
Entamoeba histolytica glycogenphosphorylase, putative 0.0289 0.068 0.2628
Echinococcus granulosus mannosyl oligosaccharide 12 alpha mannosidase 0.0147 0.031 0.0309
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.0124 0.025 0.0281
Brugia malayi Glycosyl hydrolases family 2, sugar binding domain containing protein 0.0306 0.0725 0.0725
Mycobacterium ulcerans maltooligosyltrehalose synthase TreY 0.0038 0.0023 0.0051
Toxoplasma gondii glycosyltransferase 0.0038 0.0023 0.0078
Echinococcus multilocularis Niemann Pick C1 protein 0.012 0.0238 0.0235
Brugia malayi CXXC zinc finger family protein 0.0029 0.0001 0.0001
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0006 0.0005
Onchocerca volvulus 0.0242 0.0557 0.0734
Trichomonas vaginalis trehalase, putative 0.0429 0.1049 0.3922
Loa Loa (eye worm) hypothetical protein 0.0429 0.1049 0.1049
Loa Loa (eye worm) hypothetical protein 0.0066 0.0099 0.0099
Trichomonas vaginalis glucosylceramidase, putative 0.0554 0.1375 0.5172
Mycobacterium ulcerans alpha-L-fucosidase 0.1775 0.4572 1
Mycobacterium ulcerans glycosyl hydrolase 0.0066 0.0099 0.0216
Echinococcus multilocularis fucosidase, alpha L 1, tissue 0.1775 0.4572 0.457
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0924 0.2345 0.9056
Brugia malayi trehalase 0.0149 0.0314 0.0314
Loa Loa (eye worm) hypothetical protein 0.0041 0.0033 0.0033
Loa Loa (eye worm) hypothetical protein 0.0149 0.0314 0.0314
Schistosoma mansoni hypothetical protein 0.0177 0.0388 0.0436
Echinococcus granulosus sterol regulatory element binding protein 0.0051 0.0059 0.0058
Entamoeba histolytica fatty acid elongase, putative 0.0164 0.0354 0.1367
Trichomonas vaginalis sucrase-isomaltase, putative 0.0924 0.2345 0.8882
Trichomonas vaginalis glycogen phosphorylase, putative 0.0668 0.1673 0.631
Brugia malayi Glycosyl hydrolases family 38 protein 0.0194 0.0434 0.0434
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0061 0.0083 0.0083
Brugia malayi Calcitonin receptor-like protein seb-1 0.0061 0.0083 0.0083
Trichomonas vaginalis glucosylceramidase, putative 0.0526 0.1301 0.4889
Echinococcus multilocularis glycogen phosphorylase 0.0668 0.1673 0.167
Trichomonas vaginalis glucosylceramidase, putative 0.0801 0.2023 0.7649
Mycobacterium tuberculosis Maltooligosyltrehalose trehalohydrolase TreZ 0.0038 0.0023 0.0073
Trichomonas vaginalis alpha-mannosidase, putative 0.0366 0.0882 0.3284
Trichomonas vaginalis glucosylceramidase, putative 0.0801 0.2023 0.7649
Echinococcus multilocularis glycogen phosphorylase 0.0668 0.1673 0.167
Loa Loa (eye worm) hypothetical protein 0.0147 0.031 0.031
Entamoeba histolytica alpha-amylase family protein 0.0038 0.0023 0.0091
Schistosoma mansoni starch branching enzyme II 0.0038 0.0023 0.0025
Toxoplasma gondii melibiase subfamily protein 0.0473 0.1164 0.4488
Echinococcus granulosus glycogen debranching enzyme 0.0557 0.1383 0.1382
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0093 0.0104
Loa Loa (eye worm) hypothetical protein 0.0147 0.031 0.031
Mycobacterium tuberculosis 1,4-alpha-glucan branching enzyme GlgB (glycogen branching enzyme) 0.0038 0.0023 0.0073
Schistosoma mansoni alpha-amylase 0.0158 0.0338 0.0381
Entamoeba histolytica hypothetical protein 0.0038 0.0023 0.0091
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0493 0.1216 0.4561
Trichomonas vaginalis conserved hypothetical protein 0.007 0.0108 0.0324
Loa Loa (eye worm) hypothetical protein 0.0194 0.0434 0.0434
Onchocerca volvulus Glucosylceramidase homolog 0.0526 0.1301 0.1715
Loa Loa (eye worm) hypothetical protein 0.0429 0.1049 0.1049
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.023 0.0526 0.1921
Trichomonas vaginalis alpha-glucosidase, putative 0.0493 0.1216 0.4561
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative 0.0051 0.0058 0.0133
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0473 0.1164 0.1312
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0093 0.0093
Onchocerca volvulus Glycogen phosphorylase homolog 0.0668 0.1673 0.2204
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0141 0.0293 0.0292
Plasmodium vivax beta-ketoacyl-acyl carrier protein synthase III precursor, putative 0.1263 0.3232 1
Echinococcus multilocularis protein dispatched 1 0.0059 0.0078 0.0075
Entamoeba histolytica fatty acid elongase, putative 0.0164 0.0354 0.1367
Schistosoma mansoni glycogen phosphorylase 0.0289 0.068 0.0766
Trichomonas vaginalis alpha-mannosidase 2c1, putative 0.0241 0.0556 0.2039
Loa Loa (eye worm) hypothetical protein 0.0429 0.1049 0.1049
Schistosoma mansoni beta-galactosidase 0.0916 0.2324 0.2619
Schistosoma mansoni hypothetical protein 0.0044 0.0039 0.0043
Echinococcus granulosus Glycosyl transferase family 35 0.0668 0.1673 0.1672
Leishmania major hypothetical protein, conserved 0.0051 0.0058 0.0224
Brugia malayi follicle stimulating hormone receptor 0.0238 0.0548 0.0548
Giardia lamblia 4-alpha-glucanotransferase, amylo-alpha-1,6-glucosidase 0.0557 0.1383 0.824
Echinococcus multilocularis lysosomal alpha glucosidase 0.3848 1 1
Onchocerca volvulus 0.0194 0.0434 0.0571
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0801 0.2023 0.2023
Echinococcus granulosus trehalose 6 phosphate hydrolase 0.0038 0.0023 0.0022
Mycobacterium ulcerans trehalose synthase TreS 0.0038 0.0023 0.0051
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0059 0.0078 0.0078
Schistosoma mansoni hypothetical protein 0.005 0.0054 0.006
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0061 0.0083 0.0083
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0006 0.0002
Onchocerca volvulus 0.0029 0.0001 0.0001
Loa Loa (eye worm) mannosidase 0.0147 0.031 0.031
Toxoplasma gondii Alpha-amylase AMY3, putative 0.0038 0.0023 0.0078
Trichomonas vaginalis conserved hypothetical protein 0.0147 0.031 0.1095
Chlamydia trachomatis glycogen phosphorylase 0.0668 0.1673 0.5141
Schistosoma mansoni phosphorylase B kinase alpha kpb1 0.0066 0.0099 0.011
Brugia malayi Importin beta-1 subunit 0.003 0.0003 0.0003
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.1018 0.259 1
Brugia malayi Alpha-L-fucosidase family protein 0.1398 0.3585 0.3585
Plasmodium vivax hypothetical protein, conserved 0.028 0.0658 0.2027
Echinococcus granulosus non lysosomal glucosylceramidase 0.0442 0.1083 0.1082
Entamoeba histolytica beta/alpha-amylase precursor, putative 0.0038 0.0023 0.0091
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0493 0.1216 0.4561
Trichomonas vaginalis glycoside hydrolases, putative 0.1036 0.2637 1
Brugia malayi Pre-SET motif family protein 0.0031 0.0006 0.0006
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0147 0.031 0.1095
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0473 0.1164 0.1312
Loa Loa (eye worm) hypothetical protein 0.0127 0.0257 0.0257
Trypanosoma cruzi lysosomal alpha-mannosidase precursor, putative 0.0232 0.0533 0.1874
Entamoeba histolytica hypothetical protein 0.0044 0.0039 0.0151
Loa Loa (eye worm) alpha amylase 0.0158 0.0338 0.0338
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0044 0.0039 0.0038
Loa Loa (eye worm) trehalase 0.0149 0.0314 0.0314
Brugia malayi Trehalase family protein 0.0429 0.1049 0.1049
Loa Loa (eye worm) hypothetical protein 0.0066 0.0099 0.0099
Echinococcus granulosus geminin 0.0177 0.0388 0.0387
Schistosoma mansoni hypothetical protein 0.005 0.0054 0.006
Trichomonas vaginalis alpha-glucosidase, putative 0.1018 0.259 0.9818
Echinococcus granulosus tar DNA binding protein 0.0064 0.0093 0.0092
Trypanosoma brucei lysosomal alpha-mannosidase precursor, putative 0.0174 0.038 0.1455
Brugia malayi phosphorylase B kinase beta regulatory chain 0.0066 0.0099 0.0099
Loa Loa (eye worm) hypothetical protein 0.0051 0.0059 0.0059
Trichomonas vaginalis glycoside hydrolase, putative 0.0745 0.1876 0.7086
Echinococcus multilocularis lysosomal alpha mannosidase 0.0232 0.0533 0.0529
Echinococcus multilocularis cpg binding protein 0.0031 0.0005 0.0002
Echinococcus multilocularis bile acid beta glucosidase 0.0442 0.1083 0.108
Echinococcus multilocularis non lysosomal glucosylceramidase 0.0442 0.1083 0.108
Entamoeba histolytica 1,4-alpha-glucan branching enzyme, putative 0.0038 0.0023 0.0091
Entamoeba histolytica fatty acid elongase, putative 0.0164 0.0354 0.1367
Trypanosoma brucei inosine-guanine nucleoside hydrolase 0.0051 0.0058 0.0212
Trypanosoma cruzi glycosyl hydrolase-like protein, putative 0.0493 0.1216 0.4572
Onchocerca volvulus 0.0429 0.1049 0.1382
Loa Loa (eye worm) beta-glucuronidase 0.0282 0.0663 0.0663
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0093 0.0093
Entamoeba histolytica Inosine-uridine preferring nucleoside hydrolase, putative 0.0051 0.0058 0.0224
Echinococcus multilocularis Niemann Pick C1 protein 0.0171 0.0372 0.0369
Echinococcus granulosus expressed conserved protein 0.0112 0.0219 0.0218
Brugia malayi hypothetical protein 0.0066 0.0099 0.0099
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0093 0.009
Loa Loa (eye worm) hypothetical protein 0.003 0.0003 0.0003
Trichomonas vaginalis mannosyl-oligosaccharide alpha-1,2-mannosidase, putative 0.0147 0.031 0.1095
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0147 0.031 0.1095
Trichomonas vaginalis glucosylceramidase, putative 0.0526 0.1301 0.4889
Echinococcus granulosus Niemann Pick C1 protein 0.0171 0.0372 0.0371
Schistosoma mansoni glycogen phosphorylase 0.0668 0.1673 0.1885
Brugia malayi Niemann-Pick C1 protein precursor 0.012 0.0238 0.0238
Trichomonas vaginalis glycogen debranching enzyme, putative 0.0557 0.1383 0.52
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0099 0.0288
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.1018 0.259 0.9818
Schistosoma mansoni hypothetical protein 0.0177 0.0388 0.0436
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0063 0.0089 0.01
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0093 0.0104
Brugia malayi hypothetical protein 0.0125 0.0252 0.0252
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0473 0.1164 0.1161
Trichomonas vaginalis inosine-uridine preferring nucleoside hydrolase, putative 0.0051 0.0058 0.0133
Trypanosoma brucei glycosyl hydrolase-like protein 0.0493 0.1216 0.4687
Trichomonas vaginalis conserved hypothetical protein 0.0066 0.0099 0.0288
Entamoeba histolytica alpha-amylase family protein 0.0038 0.0023 0.0091
Loa Loa (eye worm) hypothetical protein 0.0493 0.1216 0.1216
Loa Loa (eye worm) hypothetical protein 0.0916 0.2324 0.2324
Echinococcus multilocularis geminin 0.0177 0.0388 0.0385
Echinococcus multilocularis expressed conserved protein 0.0112 0.0219 0.0216
Treponema pallidum hypothetical protein 0.0149 0.0314 0.5
Loa Loa (eye worm) TRE-2 protein 0.0429 0.1049 0.1049
Trichomonas vaginalis alpha-glucosidase, putative 0.1018 0.259 0.9818
Schistosoma mansoni hypothetical protein 0.0321 0.0766 0.0863
Schistosoma mansoni lysosomal alpha-mannosidase (mannosidase alpha class 2b member 1) 0.0194 0.0434 0.0488
Brugia malayi RNA, U transporter 1 0.0086 0.0149 0.0149
Trypanosoma cruzi hypothetical protein, conserved 0.1018 0.259 1
Brugia malayi hypothetical protein 0.0287 0.0677 0.0677
Echinococcus multilocularis survival motor neuron protein 1 0.0287 0.0677 0.0674
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0093 0.0104
Entamoeba histolytica oligo-1,6-glucosidase, putative 0.0158 0.0338 0.1307
Loa Loa (eye worm) hypothetical protein 0.0149 0.0314 0.0314
Echinococcus granulosus importin subunit beta 1 0.003 0.0003 0.0002
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.04 0.0972 0.3628
Schistosoma mansoni alpha-amylase 0.0158 0.0338 0.0381
Echinococcus multilocularis phosphorylase b kinase regulatory 0.0066 0.0099 0.0095
Brugia malayi Pre-SET motif family protein 0.0212 0.048 0.048
Trichomonas vaginalis glucosylceramidase, putative 0.0801 0.2023 0.7649
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0093 0.0104
Trichomonas vaginalis glycogen debranching enzyme, putative 0.0557 0.1383 0.52
Entamoeba histolytica hypothetical protein 0.0044 0.0039 0.0151
Brugia malayi Alpha amylase, catalytic domain containing protein 0.0158 0.0338 0.0338
Schistosoma mansoni hypothetical protein 0.0141 0.0293 0.0329
Brugia malayi hypothetical protein 0.0429 0.1049 0.1049
Brugia malayi TAR-binding protein 0.0064 0.0093 0.0093
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0093 0.0093
Echinococcus multilocularis beta mannosidase 0.0164 0.0353 0.035
Trichomonas vaginalis alpha-glucosidase, putative 0.0493 0.1216 0.4561
Echinococcus granulosus phosphorylase b kinase regulatory 0.0066 0.0099 0.0098
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.1018 0.259 0.259
Brugia malayi Beta-glucuronidase precursor 0.0282 0.0663 0.0663
Mycobacterium ulcerans glycogen branching protein 0.0038 0.0023 0.0051
Echinococcus granulosus glycogen phosphorylase 0.0668 0.1673 0.1672
Loa Loa (eye worm) hypothetical protein 0.0429 0.1049 0.1049
Trichomonas vaginalis endoplasmic reticulum mannosyl-oligosaccharide 1,2-alpha-mannosidase, putative 0.0147 0.031 0.1095
Echinococcus multilocularis thyroid hormone receptor alpha 0.0164 0.0355 0.0351
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0493 0.1216 0.4694
Trichomonas vaginalis glucosylceramidase, putative 0.0801 0.2023 0.7649
Loa Loa (eye worm) hypothetical protein 0.0063 0.0089 0.0089
Mycobacterium tuberculosis Probable glucanase GlgE 0.0038 0.0023 0.0073
Plasmodium falciparum beta-ketoacyl-ACP synthase III 0.1263 0.3232 1
Brugia malayi Melibiase family protein 0.04 0.0972 0.0972
Brugia malayi Trehalase family protein 0.0149 0.0314 0.0314
Echinococcus multilocularis endoplasmic reticulum mannosyl oligosaccharide 0.0147 0.031 0.0306
Trichomonas vaginalis alpha-glucosidase, putative 0.1018 0.259 0.9818
Brugia malayi hypothetical protein 0.0044 0.0039 0.0039
Loa Loa (eye worm) hypothetical protein 0.0429 0.1049 0.1049
Trypanosoma brucei inosine-adenosine-guanosine-nucleosidehydrolase 0.0444 0.1088 0.4192
Loa Loa (eye worm) hypothetical protein 0.0031 0.0006 0.0006
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0801 0.2023 0.2023
Loa Loa (eye worm) hypothetical protein 0.0149 0.0314 0.0314
Loa Loa (eye worm) abnormal chemotaxis protein 14 0.0051 0.0059 0.0059
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0212 0.048 0.048
Echinococcus multilocularis glucan (1,4 alpha), branching enzyme 1 0.0038 0.0023 0.002
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0141 0.0293 0.0289
Loa Loa (eye worm) RNA binding protein 0.0064 0.0093 0.0093
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0238 0.0548 0.0548
Schistosoma mansoni alpha-glucosidase 0.3416 0.887 1
Mycobacterium tuberculosis 3-oxoacyl-[acyl-carrier-protein] synthase III FabH (beta-ketoacyl-ACP synthase III) (KAS III) 0.1263 0.3232 1
Trypanosoma cruzi hypothetical protein, conserved 0.1018 0.259 1
Trichomonas vaginalis conserved hypothetical protein 0.0429 0.1049 0.3922
Loa Loa (eye worm) hypothetical protein 0.0281 0.0659 0.0659
Schistosoma mansoni alpha-l-fucosidase 0.1398 0.3585 0.4041

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 0.00000026 M Effective dose for differentiation -inducing activity against human promyelotic leukemia cells ChEMBL. 3184125
ED50 (functional) = 0.00000026 M Effective dose for differentiation -inducing activity against human promyelotic leukemia cells ChEMBL. 3184125
Ratio (functional) = 0.0077 Ratio of the ED50 of compound to that of ED50 of retinoic acid, expressed as relative activity ChEMBL. 3184125

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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