Detailed information for compound 271093

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 346.422 | Formula: C22H22N2O2
  • H donors: 3 H acceptors: 2 LogP: 4.31 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCNc1ccccc1c1ccccc1NC(=O)Cc1ccc(cc1)O
  • InChi: 1S/C22H22N2O2/c1-2-23-20-9-5-3-7-18(20)19-8-4-6-10-21(19)24-22(26)15-16-11-13-17(25)14-12-16/h3-14,23,25H,2,15H2,1H3,(H,24,26)
  • InChiKey: REDALYKSMQNCMH-UHFFFAOYSA-N  


Substructure search Similarity search

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
Brugia malayi MBOAT family protein 0.0135 0.0893 0.1908
Loa Loa (eye worm) intermediate filament protein 0.0058 0.0331 0.0322
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0265 0.0256
Schistosoma mansoni hypothetical protein 0.0365 0.2572 0.2565
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0.044 0.0892
Echinococcus multilocularis lysophospholipid acyltransferase 7 0.0135 0.0893 0.0884
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0049 0.0269 0.026
Schistosoma mansoni inositol monophosphatase 0.004 0.0196 0.0187
Trichomonas vaginalis glucosylceramidase, putative 0.0272 0.1898 1
Loa Loa (eye worm) O-glycosyl hydrolase family 30 protein 0.0272 0.1898 0.189
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0137 0.0128
Onchocerca volvulus 0.0031 0.0137 0.0742
Plasmodium vivax dihydrolipoyl dehydrogenase, mitochondrial, putative 0.0017 0.0034 0.0172
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0135 0.0893 0.0884
Plasmodium vivax hypothetical protein, conserved 0.0073 0.044 0.4826
Mycobacterium tuberculosis Probable reductase 0.0114 0.0739 0.2149
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.0034 0.0018
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0.0045 0.0059
Onchocerca volvulus Bile acid receptor homolog 0.003 0.0124 0.0664
Toxoplasma gondii NADPH-glutathione reductase 0.0017 0.0034 0.0035
Trichomonas vaginalis glucosylceramidase, putative 0.0179 0.1213 0.6328
Trichomonas vaginalis inositol monophosphatase, putative 0.004 0.0196 0.0872
Echinococcus multilocularis beta LACTamase domain containing family member 0.0073 0.044 0.0432
Brugia malayi follicle stimulating hormone receptor 0.0249 0.173 0.3695
Mycobacterium tuberculosis Probable hydrolase 0.0073 0.044 0.1241
Brugia malayi Inositol-1 0.004 0.0196 0.0419
Onchocerca volvulus Glucosylceramidase homolog 0.0179 0.1213 0.6985
Brugia malayi Cytochrome P450 family protein 0.0023 0.0074 0.0157
Brugia malayi diacylglycerol acyltransferase 0.0135 0.0893 0.1908
Loa Loa (eye worm) hypothetical protein 0.0016 0.0022 0.0012
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0021 0.0058 0.0071
Brugia malayi nuclear receptor RXR 0.0016 0.0022 0.0046
Trypanosoma brucei dihydrolipoamide dehydrogenase, point mutation 0.0017 0.0034 0.0018
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0072 0.0437 0.0428
Schistosoma mansoni lamin 0.0058 0.0331 0.0322
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0014 0.0009 0.002
Loa Loa (eye worm) hypothetical protein 0.0028 0.0112 0.0103
Loa Loa (eye worm) membrane bound O-acyltransferase domain containing 1 0.0135 0.0893 0.0884
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.003 0.0124 0.0115
Loa Loa (eye worm) inositol-1 0.004 0.0196 0.0187
Echinococcus granulosus beta LACTamase domain containing family member 0.0073 0.044 0.0432
Plasmodium vivax thioredoxin reductase, putative 0.005 0.0272 0.2895
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0196 0.0367
Mycobacterium tuberculosis Probable esterase LipL 0.0073 0.044 0.1241
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0045 0.0042
Brugia malayi Nuclear hormone receptor-like 1 0.0016 0.0022 0.0046
Schistosoma mansoni leukocyte receptor cluster (lrc) member 4 protein 0.0135 0.0893 0.0884
Onchocerca volvulus 0.0058 0.0331 0.1868
Trichomonas vaginalis esterase, putative 0.0073 0.044 0.2183
Echinococcus granulosus bloom syndrome protein 0.0023 0.0072 0.0062
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0034 0.0018
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0.0045 0.0059
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.0034 0.0018
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0133 0.0878 0.0869
Echinococcus multilocularis fructose 1,6 bisphosphatase 1 0.0653 0.4681 0.4676
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0114 0.0739 0.2149
Onchocerca volvulus 0.003 0.0124 0.0664
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.003 0.0124 0.0115
Leishmania major trypanothione reductase 0.005 0.0272 0.0529
Brugia malayi Steroid receptor seven-up type 2 0.003 0.0124 0.0264
Schistosoma mansoni hypothetical protein 0.0022 0.0066 0.0057
Brugia malayi Nuclear hormone receptor family member nhr-31 0.003 0.0124 0.0264
Trypanosoma cruzi fructose-1,6-bisphosphatase, cytosolic, putative 0.0653 0.4681 1
Loa Loa (eye worm) hypothetical protein 0.1246 0.9014 0.9013
Brugia malayi glutathione reductase 0.005 0.0272 0.058
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0034 0.0018
Leishmania major 2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein 0.0017 0.0034 0.0018
Brugia malayi Nuclear hormone receptor E75 0.0014 0.0009 0.002
Toxoplasma gondii fructose-bisphospatase I 0.0243 0.1683 0.3571
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0034 0.0018
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0019 0.0045 0.0035
Toxoplasma gondii acyl-CoA:diacylglycerol acyltransferase 1-related enzyme 0.0135 0.0893 0.1878
Trypanosoma brucei dihydrolipoamide dehydrogenase 0.0017 0.0034 0.0018
Trypanosoma brucei glycerol uptake protein, putative 0.0135 0.0893 0.1864
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.003 0.0129 0.012
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0028 0.0112 0.0103
Trypanosoma cruzi hypothetical protein, conserved 0.0073 0.044 0.0892
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0035 0.0166 0.0403
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0039 0.0029
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0049 0.0269 0.026
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0021 0.0058 0.0049
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.003 0.0124 0.0115
Trypanosoma brucei glycerol uptake protein, putative 0.0135 0.0893 0.1864
Schistosoma mansoni zinc finger protein 0.0135 0.0893 0.0884
Echinococcus granulosus geminin 0.0365 0.2572 0.2565
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.003 0.0124 0.0264
Brugia malayi dihydrolipoyl dehydrogenase, mitochondrial precursor, putative 0.0017 0.0034 0.0072
Echinococcus granulosus lysophospholipid acyltransferase 7 0.0135 0.0893 0.0884
Echinococcus multilocularis diacylglycerol O acyltransferase 1 0.0135 0.0893 0.0884
Brugia malayi Pre-SET motif family protein 0.0031 0.0137 0.0293
Trichomonas vaginalis glucosylceramidase, putative 0.0272 0.1898 1
Brugia malayi MBOAT family protein 0.0135 0.0893 0.1908
Loa Loa (eye worm) hypothetical protein 0.0058 0.0331 0.0322
Loa Loa (eye worm) hypothetical protein 0.0016 0.0022 0.0012
Echinococcus granulosus lamin 0.0058 0.0331 0.0322
Onchocerca volvulus 0.0073 0.044 0.2501
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0114 0.0739 0.2149
Trichomonas vaginalis glucosylceramidase, putative 0.0272 0.1898 1
Mycobacterium ulcerans beta-lactamase 0.0073 0.044 1
Toxoplasma gondii ABC1 family protein 0.0073 0.044 0.0908
Trichomonas vaginalis myo inositol monophosphatase, putative 0.004 0.0196 0.0872
Echinococcus granulosus nuclear receptor 2DBD gamma 0.003 0.0124 0.0115
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.003 0.0124 0.0664
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.003 0.0124 0.0115
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.003 0.0124 0.0115
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0058 0.0453
Echinococcus multilocularis ecdysone induced protein 78C 0.003 0.0124 0.0115
Trichomonas vaginalis glucosylceramidase, putative 0.0188 0.1284 0.6706
Trypanosoma cruzi trypanothione reductase, putative 0.0017 0.0034 0.0018
Brugia malayi photoreceptor-specific nuclear receptor 0.003 0.0124 0.0264
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.003 0.0124 0.0115
Trichomonas vaginalis DNA helicase recq1, putative 0.0023 0.0072 0.0205
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0249 0.173 0.1722
Schistosoma mansoni dihydrolipoamide dehydrogenase 0.0017 0.0034 0.0024
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0019 0.0045 0.0034
Schistosoma mansoni zinc finger protein 0.0016 0.0025 0.0016
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0021 0.0058 0.0075
Loa Loa (eye worm) thioredoxin reductase 0.005 0.0272 0.0263
Mycobacterium tuberculosis Conserved protein 0.0073 0.044 0.1241
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0073 0.044 0.1241
Brugia malayi hypothetical protein 0.0016 0.0022 0.0046
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0072 0.0437 0.0884
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0034 0.0018
Echinococcus granulosus nuclear receptor 2DBD gamma 0.003 0.0124 0.0115
Trichomonas vaginalis conserved hypothetical protein 0.0135 0.0893 0.4611
Brugia malayi fructose-1,6-bisphosphatase 0.0653 0.4681 1
Leishmania major hypothetical protein, conserved 0.0135 0.0893 0.1864
Echinococcus multilocularis inositol monophosphatase 1 0.004 0.0196 0.0187
Loa Loa (eye worm) hypothetical protein 0.004 0.0203 0.0194
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0019 0.0045 0.0131
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.003 0.0124 0.0115
Brugia malayi beta-lactamase family protein 0.0073 0.044 0.0941
Echinococcus granulosus ecdysone induced protein 78C 0.003 0.0124 0.0115
Echinococcus granulosus intermediate filament protein 0.0058 0.0331 0.0322
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0019 0.0045 0.0035
Echinococcus granulosus histone lysine methyltransferase setb 0.0049 0.0269 0.026
Brugia malayi Bromodomain containing protein 0.0079 0.0485 0.1037
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.003 0.0124 0.0115
Loa Loa (eye worm) fructose-1,6-bisphosphatase 0.0653 0.4681 0.4676
Trypanosoma brucei dihydrolipoyl dehydrogenase 0.0017 0.0034 0.0018
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0021 0.0058 0.0071
Mycobacterium tuberculosis Conserved protein 0.0073 0.044 0.1241
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.003 0.0124 0.0115
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0021 0.0058 0.0071
Schistosoma mansoni ap endonuclease 0.0021 0.0058 0.0049
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.003 0.0124 0.0115
Loa Loa (eye worm) hypothetical protein 0.0018 0.0038 0.0029
Mycobacterium ulcerans esterase/lipase LipP 0.0073 0.044 1
Brugia malayi MBOAT family protein 0.0135 0.0893 0.1908
Trichomonas vaginalis porcupine, putative 0.0135 0.0893 0.4611
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0135 0.0893 0.0884
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.003 0.0124 0.0115
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0135 0.0893 0.0884
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0072 0.0437 0.0428
Leishmania major glycerol uptake protein, putative 0.0135 0.0893 0.1864
Echinococcus multilocularis isocitrate dehydrogenase 0.0019 0.0045 0.0035
Echinococcus granulosus FTZ F1 alpha 0.003 0.0124 0.0115
Schistosoma mansoni methyl-cpg binding protein mbd 0.0018 0.0039 0.0029
Mycobacterium ulcerans hypothetical protein 0.0073 0.044 1
Mycobacterium ulcerans lipase LipD 0.0073 0.044 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.003 0.0124 0.0264
Schistosoma mansoni ap endonuclease 0.0021 0.0058 0.0049
Chlamydia trachomatis dihydrolipoyl dehydrogenase 0.0017 0.0034 0.5
Trypanosoma brucei hypothetical protein, conserved 0.0073 0.044 0.0892
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.044 0.2183
Brugia malayi PHD-finger family protein 0.0026 0.0099 0.0212
Brugia malayi isocitrate dehydrogenase 0.0019 0.0045 0.0096
Onchocerca volvulus 0.025 0.1733 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.003 0.0124 0.0115
Brugia malayi MBOAT family protein 0.0135 0.0893 0.1908
Loa Loa (eye worm) hhat protein 0.0135 0.0893 0.0884
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.004 0.0196 1
Brugia malayi nuclear receptor NHR-88 0.0014 0.0009 0.002
Schistosoma mansoni thyroid hormone receptor 0.0162 0.1094 0.1086
Trypanosoma brucei sedoheptulose-1,7-bisphosphatase 0.0243 0.1683 0.356
Toxoplasma gondii fructose-bisphospatase II 0.0653 0.4681 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.003 0.0124 0.0264
Schistosoma mansoni inositol monophosphatase 0.004 0.0196 0.0187
Leishmania major glycerol uptake protein, putative 0.0135 0.0893 0.1864
Toxoplasma gondii exonuclease III APE 0.0021 0.0058 0.0088
Echinococcus granulosus o acyltransferase membrane bound domain 0.0135 0.0893 0.0884
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0133 0.0878 0.0869
Trichomonas vaginalis glucosylceramidase, putative 0.0272 0.1898 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.022 0.1511 0.1503
Echinococcus multilocularis Membrane bound O acyl transferase, MBOAT 0.0135 0.0893 0.0884
Entamoeba histolytica hypothetical protein, conserved 0.0135 0.0893 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.003 0.0124 0.0264
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0135 0.0893 0.0884
Plasmodium vivax glutathione reductase, putative 0.005 0.0272 0.2895
Plasmodium falciparum diacylglycerol O-acyltransferase 0.0135 0.0893 1
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0072 0.0437 0.0884
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0024 0.0081 0.0072
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0021 0.0058 0.1512
Onchocerca volvulus Protein ultraspiracle homolog 0.003 0.0124 0.0664
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.002 0.0052 0.0212
Treponema pallidum alginate O-acetylation protein (algI) 0.0135 0.0893 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.003 0.0124 0.0264
Brugia malayi nuclear hormone receptor family member odr-7 0.0014 0.0009 0.002
Schistosoma mansoni diacylglycerol O-acyltransferase 1 0.0135 0.0893 0.0884
Brugia malayi hypothetical protein 0.018 0.1223 0.2613
Trypanosoma brucei trypanothione reductase 0.005 0.0272 0.0529
Loa Loa (eye worm) hypothetical protein 0.003 0.0124 0.0115
Brugia malayi nuclear receptor NHR-88 0.003 0.0124 0.0264
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.0265 0.0256
Schistosoma mansoni o-acyltransferase (membrane bound) domain containing protein 0.0135 0.0893 0.0884
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0073 0.044 0.0432
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0034 0.0018
Loa Loa (eye worm) hypothetical protein 0.0073 0.044 0.0432
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0016 0.0022 0.0012
Loa Loa (eye worm) diacylglycerol acyltransferase 0.0135 0.0893 0.0884
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.003 0.0124 0.0115
Loa Loa (eye worm) hypothetical protein 0.0045 0.0236 0.0227
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.003 0.0124 0.0115
Schistosoma mansoni thyroid hormone receptor 0.0162 0.1094 0.1086
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.044 0.2183
Mycobacterium tuberculosis Probable lipase LipD 0.0073 0.044 0.1241
Brugia malayi Nuclear hormone receptor family member nhr-25 0.003 0.0124 0.0264
Onchocerca volvulus 0.0073 0.044 0.2501
Loa Loa (eye worm) glutathione reductase 0.005 0.0272 0.0263
Echinococcus multilocularis bloom syndrome protein 0.0023 0.0072 0.0062
Echinococcus multilocularis thioredoxin glutathione reductase 0.005 0.0272 0.0263
Brugia malayi Nuclear hormone receptor family member nhr-19 0.003 0.0124 0.0264
Brugia malayi Nuclear hormone receptor-like 1 0.003 0.0124 0.0264
Trichomonas vaginalis myo inositol monophosphatase, putative 0.004 0.0196 0.0872
Trypanosoma cruzi GUP1, putative 0.0135 0.0893 0.1864
Schistosoma mansoni hypothetical protein 0.0133 0.0878 0.0869
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.003 0.0124 0.0264
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0045 0.0042
Schistosoma mansoni membrane-bound acyltransferase/hhat 0.0135 0.0893 0.0884
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0072 0.0437 0.0933
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0049 0.0265 0.0566
Echinococcus granulosus dihydrolipoamide dehydrogenase 0.0017 0.0034 0.0024
Brugia malayi Bromodomain containing protein 0.004 0.0202 0.0432
Schistosoma mansoni nuclear hormone receptor 0.003 0.0124 0.0115
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0073 0.044 0.1241
Brugia malayi beta-lactamase family protein 0.0073 0.044 0.0941
Loa Loa (eye worm) hypothetical protein 0.0016 0.0022 0.0012
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.003 0.0124 0.0115
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0034 0.0018
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.0265 0.0256
Loa Loa (eye worm) beta-lactamase 0.0073 0.044 0.0432
Echinococcus granulosus methyl CpG binding domain protein 2 0.0018 0.0039 0.0029
Trichomonas vaginalis conserved hypothetical protein 0.0135 0.0893 0.4611
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0021 0.0058 0.0049
Brugia malayi nuclear receptor NHR-67 0.0014 0.0009 0.002
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0073 0.044 0.1241
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0049 0.0269 0.026
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0028 0.0112 0.0103
Onchocerca volvulus 0.0073 0.044 0.2501
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0016 0.0022 0.0012
Trypanosoma cruzi GUP1, putative 0.0135 0.0893 0.1864
Loa Loa (eye worm) hypothetical protein 0.0073 0.044 0.0432
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0019 0.0045 0.0302
Plasmodium falciparum glutathione reductase 0.005 0.0272 0.2771
Brugia malayi ecdysone receptor 0.0014 0.0009 0.002
Brugia malayi nuclear receptor RXR 0.0014 0.0009 0.002
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0016 0.0022 0.0012
Onchocerca volvulus 0.018 0.1223 0.7042
Loa Loa (eye worm) hypothetical protein 0.0135 0.0893 0.0884
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0016 0.0022 0.0012
Loa Loa (eye worm) hypothetical protein 0.0075 0.0452 0.0443
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0265 0.0256
Loa Loa (eye worm) MBOAT family protein 0.0135 0.0893 0.0884
Onchocerca volvulus 0.0058 0.0331 0.1868
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.005 0.0272 0.0726
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0049 0.0265 0.0256
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.003 0.0124 0.0115
Entamoeba histolytica hypothetical protein 0.0135 0.0893 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0124 0.0115
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0073 0.044 1
Loa Loa (eye worm) hypothetical protein 0.0073 0.044 0.0432
Loa Loa (eye worm) hypothetical protein 0.0027 0.0104 0.0095
Brugia malayi tailless protein 0.0014 0.0009 0.002
Trichomonas vaginalis glucosylceramidase, putative 0.0272 0.1898 1
Trichomonas vaginalis conserved hypothetical protein 0.0135 0.0893 0.4611
Trichomonas vaginalis penicillin-binding protein, putative 0.0073 0.044 0.2183
Loa Loa (eye worm) hypothetical protein 0.0049 0.0269 0.026
Trypanosoma cruzi dihydrolipoyl dehydrogenase, putative 0.0017 0.0034 0.0018
Echinococcus granulosus lamin dm0 0.0058 0.0331 0.0322
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0072 0.0437 0.0428
Leishmania major dihydrolipoamide dehydrogenase, putative 0.0017 0.0034 0.0018
Brugia malayi Hhat protein 0.0135 0.0893 0.1908
Loa Loa (eye worm) hypothetical protein 0.0073 0.044 0.0432
Echinococcus multilocularis dihydrolipoamide dehydrogenase 0.0017 0.0034 0.0024
Echinococcus granulosus o acyltransferase membrane bound domain 0.0135 0.0893 0.0884
Schistosoma mansoni hypothetical protein 0.0365 0.2572 0.2565
Trypanosoma cruzi fructose-1,6-bisphosphatase, cytosolic, putative 0.0653 0.4681 1
Schistosoma mansoni hypothetical protein 0.0135 0.0893 0.0884
Schistosoma mansoni zinc finger protein 0.0021 0.0058 0.0049
Echinococcus multilocularis protein cysteine N palmitoyltransferase 0.0135 0.0893 0.0884
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.0058 0.0132
Mycobacterium tuberculosis Probable lipase LipE 0.0073 0.044 0.1241
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0073 0.044 0.0941
Onchocerca volvulus 0.0135 0.0893 0.5127
Trichomonas vaginalis D-aminoacylase, putative 0.0073 0.044 0.2183
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0058 0.0331 0.0322
Trichomonas vaginalis glucosylceramidase, putative 0.0188 0.1284 0.6706
Brugia malayi Thioredoxin reductase 0.005 0.0272 0.058
Loa Loa (eye worm) steroid hormone receptor 0.003 0.0124 0.0115
Trichomonas vaginalis penicillin-binding protein, putative 0.0073 0.044 0.2183
Brugia malayi steroid hormone receptor 0.003 0.0124 0.0264
Echinococcus multilocularis FTZ F1 alpha 0.003 0.0124 0.0115
Echinococcus granulosus protein cysteine N palmitoyltransferase 0.0135 0.0893 0.0884
Trichomonas vaginalis glucosylceramidase, putative 0.0272 0.1898 1
Brugia malayi Pre-SET motif family protein 0.022 0.1511 0.3228
Loa Loa (eye worm) hypothetical protein 0.0016 0.0022 0.0012
Mycobacterium tuberculosis Probable dehydrogenase 0.0114 0.0739 0.2149
Loa Loa (eye worm) RecQ helicase 0.0023 0.0072 0.0062
Treponema pallidum exodeoxyribonuclease (exoA) 0.0021 0.0058 0.0286
Loa Loa (eye worm) cytochrome P450 family protein 0.0023 0.0074 0.0064
Loa Loa (eye worm) bromodomain containing protein 0.0019 0.0043 0.0034
Schistosoma mansoni RAR-like nuclear receptor 0.003 0.0124 0.0115
Trichomonas vaginalis ap endonuclease, putative 0.0021 0.0058 0.0132
Trichomonas vaginalis glucosylceramidase, putative 0.0179 0.1213 0.6328
Echinococcus multilocularis musashi 0.0058 0.0331 0.0322
Mycobacterium leprae Probable lipase LipE 0.0073 0.044 0.4128
Schistosoma mansoni sterol O-acyltransferase 1 0.1381 1 1
Brugia malayi Nuclear hormone receptor E75 0.0014 0.0009 0.002
Echinococcus multilocularis o acyltransferase (membrane bound) domain 0.0135 0.0893 0.0884
Trypanosoma cruzi glycerol uptake protein, putative 0.0135 0.0893 0.1864
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0021 0.0058 0.0286
Leishmania major hypothetical protein, conserved 0.0073 0.044 0.0892
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0072 0.0437 0.0428
Mycobacterium tuberculosis Probable oxidoreductase 0.0126 0.0831 0.2432
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0045 0.0035
Loa Loa (eye worm) hypothetical protein 0.0027 0.0104 0.0095
Trichomonas vaginalis glucosylceramidase, putative 0.0179 0.1213 0.6328
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0045 0.0035
Schistosoma mansoni intermediate filament proteins 0.0058 0.0331 0.0322
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0031 0.0137 0.0258
Trypanosoma cruzi glycerol uptake protein, putative 0.0135 0.0893 0.1864
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.0265 0.0256
Entamoeba histolytica vacuolar protein sorting 26 0.0135 0.0893 1
Brugia malayi conserved hypotetical protein 0.0014 0.0009 0.002
Brugia malayi O-Glycosyl hydrolase family 30 protein 0.0272 0.1898 0.4054
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0126 0.0831 1
Entamoeba histolytica myo-inositol monophosphatase, putative 0.004 0.0196 0.1652
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0021 0.0058 0.0603
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0265 0.0256
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0073 0.044 0.0432
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0114 0.0739 0.2149
Loa Loa (eye worm) PHD-finger family protein 0.0022 0.0066 0.0057
Loa Loa (eye worm) hypothetical protein 0.0043 0.0221 0.0212
Toxoplasma gondii thioredoxin reductase 0.005 0.0272 0.0546
Schistosoma mansoni bromodomain containing protein 0.0067 0.0395 0.0386
Brugia malayi nuclear hormone receptor 0.003 0.0124 0.0264
Toxoplasma gondii pyruvate dehydrogenase complex subunit PDH-E3II 0.0017 0.0034 0.0035
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0126 0.0831 0.2432
Brugia malayi orphan nuclear receptor NR2E1 0.0014 0.0009 0.002
Schistosoma mansoni Tr4/Tr2 (homologue) 0.003 0.0124 0.0115
Schistosoma mansoni lamin 0.0058 0.0331 0.0322
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0196 0.0367
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.0265 0.0256
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0072 0.0437 0.4535
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.003 0.0124 0.0115
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0072 0.0437 0.0884
Loa Loa (eye worm) hypothetical protein 0.0135 0.0893 0.0884
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0031 0.0134 0.0125
Leishmania major 0.0653 0.4681 1
Loa Loa (eye worm) hypothetical protein 0.018 0.1223 0.1215
Brugia malayi Nuclear hormone receptor family member nhr-41 0.003 0.0124 0.0264
Brugia malayi Intermediate filament tail domain containing protein 0.0058 0.0331 0.0708
Echinococcus granulosus o acyltransferase membrane bound domain 0.0135 0.0893 0.0884
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0196 0.0367
Leishmania major acetoin dehydrogenase e3 component-like protein 0.0017 0.0034 0.0018
Echinococcus granulosus inositol monophosphatase 1 0.004 0.0196 0.0187
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0114 0.0739 0.8606
Trichomonas vaginalis set domain proteins, putative 0.025 0.1733 0.9116
Loa Loa (eye worm) hypothetical protein 0.003 0.0124 0.0115
Loa Loa (eye worm) hypothetical protein 0.003 0.0124 0.0115
Loa Loa (eye worm) hypothetical protein 0.0016 0.0022 0.0012
Brugia malayi hypothetical protein 0.0014 0.0009 0.002
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0135 0.0893 1
Schistosoma mansoni blooms syndrome DNA helicase 0.0018 0.0037 0.0028
Brugia malayi Isocitrate dehydrogenase 0.0019 0.0045 0.0096
Loa Loa (eye worm) hypothetical protein 0.0057 0.0324 0.0315
Echinococcus granulosus diacylglycerol O acyltransferase 1 0.0135 0.0893 0.0884
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0137 0.0128
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.003 0.0124 0.0115
Echinococcus multilocularis lamin dm0 0.0058 0.0331 0.0322
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0063 0.0367 0.0358
Brugia malayi Nuclear hormone receptor family member nhr-1 0.003 0.0124 0.0264
Echinococcus granulosus thioredoxin glutathione reductase 0.005 0.0272 0.0263
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0021 0.0058 0.0071
Brugia malayi Nuclear hormone receptor family member nhr-14 0.003 0.0124 0.0264
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.004 0.0196 0.0367
Trichomonas vaginalis glucosylceramidase, putative 0.0179 0.1213 0.6328
Echinococcus multilocularis zinc finger protein 0.0021 0.0058 0.0049
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0137 0.0128
Trypanosoma cruzi sedoheptulose-1,7-bisphosphatase, putative 0.0243 0.1683 0.356
Brugia malayi cytoplasmic intermediate filament protein 0.0031 0.0134 0.0287
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.004 0.0196 0.3992
Loa Loa (eye worm) MBOAT family protein 0.0135 0.0893 0.0884
Brugia malayi exodeoxyribonuclease III family protein 0.0021 0.0058 0.0124
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0038 0.0184 0.0175
Schistosoma mansoni retinoic acid receptor RXR 0.003 0.0124 0.0115
Toxoplasma gondii sedoheptulose-1,7-bisphosphatase 0.0243 0.1683 0.3571
Schistosoma mansoni steroid hormone receptor ad4bp 0.003 0.0124 0.0115
Schistosoma mansoni hypothetical protein 0.0062 0.0358 0.0349
Loa Loa (eye worm) hypothetical protein 0.1381 1 1
Leishmania major glycerol uptake protein, putative 0.0135 0.0893 0.1864
Loa Loa (eye worm) hypothetical protein 0.0135 0.0893 0.0884
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0073 0.044 0.0432
Echinococcus granulosus membrane bound acyltransferase:hhat 0.0135 0.0893 0.0884
Leishmania major glycerol uptake protein, putative 0.0135 0.0893 0.1864
Trypanosoma cruzi sedoheptulose-1,7-bisphosphatase, putative 0.0243 0.1683 0.356
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0019 0.0045 0.0042
Echinococcus granulosus fructose 16 bisphosphatase 1 0.0653 0.4681 0.4676
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.003 0.0124 0.0115
Trichomonas vaginalis glucosylceramidase, putative 0.0179 0.1213 0.6328
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0018 0.0039 0.0029
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.003 0.0124 0.0115
Brugia malayi intermediate filament protein 0.0058 0.0331 0.0708
Trichomonas vaginalis transmembrane protein nessy, putative 0.0135 0.0893 0.4611
Brugia malayi nuclear hormone receptor 0.0014 0.0009 0.002
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0063 0.0367 0.0358
Brugia malayi Bloom's syndrome protein homolog 0.0023 0.0072 0.0153
Plasmodium vivax diacylglycerol O-acyltransferase, putative 0.0135 0.0893 1
Brugia malayi hypothetical protein 0.0016 0.0022 0.0046
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0021 0.0058 0.0049
Echinococcus granulosus zinc finger protein 0.0021 0.0058 0.0049
Toxoplasma gondii hypothetical protein 0.0135 0.0893 0.1878
Schistosoma mansoni hypothetical protein 0.0016 0.0025 0.0016
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0021 0.0058 1
Schistosoma mansoni coup transcription factor 0.003 0.0124 0.0115
Brugia malayi Nuclear hormone receptor-like 1 0.0016 0.0022 0.0046
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0016 0.0022 0.0012
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0019 0.0045 0.0035
Loa Loa (eye worm) hhat protein 0.0135 0.0893 0.0884
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0038 0.0184 0.0175
Echinococcus multilocularis transcription factor Dp 1 0.0042 0.0214 0.0204
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.003 0.0124 0.0115
Trichomonas vaginalis glucosylceramidase, putative 0.0179 0.1213 0.6328
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0024 0.0081 0.0072
Echinococcus multilocularis sterol O acyltransferase 1 0.1381 1 1
Echinococcus multilocularis membrane bound acyltransferase:hhat 0.0135 0.0893 0.0884
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0072 0.0437 0.0884
Brugia malayi hypothetical protein 0.0014 0.0009 0.002
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0019 0.0045 0.0035
Mycobacterium leprae conserved hypothetical protein 0.0073 0.044 0.4128
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0019 0.0045 0.0042
Trypanosoma cruzi trypanothione reductase, putative 0.005 0.0272 0.0529
Echinococcus granulosus Membrane bound O acyl transferase MBOAT 0.0135 0.0893 0.0884
Loa Loa (eye worm) isocitrate dehydrogenase 0.0019 0.0045 0.0035
Loa Loa (eye worm) hypothetical protein 0.003 0.0124 0.0115
Schistosoma mansoni fructose-16-bisphosphatase-related 0.0653 0.4681 0.4676
Echinococcus granulosus retinoic acid receptor rxr beta a 0.003 0.0124 0.0115
Plasmodium vivax SET domain protein, putative 0.0031 0.0137 0.1359
Loa Loa (eye worm) hypothetical protein 0.0073 0.044 0.0432
Brugia malayi Nuclear hormone receptor family member nhr-25 0.003 0.0124 0.0264
Echinococcus multilocularis lamin 0.0058 0.0331 0.0322
Loa Loa (eye worm) hypothetical protein 0.0073 0.044 0.0432
Trypanosoma brucei fructose-1,6-bisphosphatase 0.0653 0.4681 1
Plasmodium falciparum thioredoxin reductase 0.005 0.0272 0.2771
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0.0045 0.0042
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.003 0.0124 0.0115
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.004 0.0196 0.0383
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0072 0.0205
Brugia malayi beta-lactamase 0.0073 0.044 0.0941
Echinococcus multilocularis thyroid hormone receptor alpha 0.0162 0.1094 0.1086
Loa Loa (eye worm) MBOAT family protein 0.0135 0.0893 0.0884
Brugia malayi nuclear hormone receptor family member nhr-6 0.0014 0.0009 0.002
Brugia malayi MBOAT family protein 0.0135 0.0893 0.1908
Trypanosoma cruzi glycerol uptake protein, putative 0.0135 0.0893 0.1864
Echinococcus multilocularis geminin 0.0365 0.2572 0.2565
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0135 0.0893 1
Echinococcus granulosus transcription factor Dp 1 0.0042 0.0214 0.0204
Trichomonas vaginalis glucosylceramidase, putative 0.0179 0.1213 0.6328
Plasmodium vivax dihydrolipoyl dehydrogenase, apicoplast, putative 0.0017 0.0034 0.0172
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0466 0.3314 1
Loa Loa (eye worm) hypothetical protein 0.003 0.0124 0.0115
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0114 0.0739 0.2149
Trypanosoma cruzi dihydrolipoamide dehydrogenase, putative 0.0017 0.0034 0.0018
Entamoeba histolytica membrane-bound O-acyltransferase (MBOAT ) family protein 0.0135 0.0893 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0126 0.0831 0.2432
Leishmania major glycerol uptake protein, putative 0.0135 0.0893 0.1864
Brugia malayi ecdysteroid receptor 0.003 0.0124 0.0264
Echinococcus granulosus fetal alzheimer antigen falz 0.0024 0.0081 0.0072
Mycobacterium tuberculosis Conserved protein 0.0073 0.044 0.1241
Loa Loa (eye worm) hypothetical protein 0.003 0.0124 0.0115
Loa Loa (eye worm) hypothetical protein 0.003 0.0124 0.0115
Toxoplasma gondii acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha 0.0135 0.0893 0.1878

Activities

Activity type Activity value Assay description Source Reference
Inhibition (functional) NSE 0 % Compound was tested for antiinflammatory activity in rats by adjuvant arthritis test after peroral administration of 50 mg/kg dose; no significant effect ChEMBL. 7241523
Inhibition (functional) = 45 % Compound was tested for antiinflammatory activity in rats by carrageenam edema test after peroral administration of 200 mg/kg dose ChEMBL. 7241523

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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