Detailed information for compound 559633

Basic information

Technical information
  • TDR Targets ID: 559633
  • Name: (7R,8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,1 2,14,15,16,17-decahydrocyclopenta[a]phenanthr ene-3,7,17-triol
  • MW: 288.381 | Formula: C18H24O3
  • H donors: 3 H acceptors: 3 LogP: 2.75 Rotable bonds: 0
    Rule of 5 violations (Lipinski): 1
  • SMILES: O[C@@H]1Cc2cc(O)ccc2[C@@H]2[C@@H]1[C@@H]1CC[C@@H]([C@]1(CC2)C)O
  • InChi: 1S/C18H24O3/c1-18-7-6-13-12-3-2-11(19)8-10(12)9-15(20)17(13)14(18)4-5-16(18)21/h2-3,8,13-17,19-21H,4-7,9H2,1H3/t13-,14+,15-,16+,17-,18+/m1/s1
  • InChiKey: CQPNIWHVQNCXHA-HTPGKPQGSA-N  


Substructure search Similarity search

Network

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Synonyms

  • estra-1,3,5(10)-triene-3,7,17-triol
  • 3398-11-6
  • NSC89844

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0094 0.0569 0.0569
Schistosoma mansoni peroxidasin 0.0444 0.3098 0.3098
Schistosoma mansoni polycystin 1-related 0.0019 0.0031 0.0031
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.006 0.0164
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0056 0.0299 0.301
Trichomonas vaginalis chromobox protein, putative 0.0073 0.0417 0.1177
Brugia malayi Pre-SET motif family protein 0.0425 0.296 0.9552
Brugia malayi hypothetical protein 0.0019 0.0031 0.0093
Schistosoma mansoni lipoxygenase 0.0054 0.0283 0.0283
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0019 0.0026 0.0052
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0025 0.0075 0.0075
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0035 0.0147 0.0137
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0056 0.0299 0.0299
Echinococcus granulosus delta-like protein 1 0.0143 0.0927 0.0919
Schistosoma mansoni cpg binding protein 0.0058 0.0312 0.0312
Schistosoma mansoni hypothetical protein 0.0033 0.0131 0.0131
Brugia malayi EGF-like domain containing protein 0.0143 0.0927 0.2987
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0323 0.321
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Brugia malayi Calcium binding EGF domain containing protein 0.0143 0.0927 0.2987
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0026 0.0013
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0025 0.0073 0.0152
Trypanosoma brucei RNA helicase, putative 0.0115 0.0721 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0079 0.046 0.046
Loa Loa (eye worm) hypothetical protein 0.0017 0.0017 0.0024
Entamoeba histolytica hypothetical protein 0.0035 0.0147 0.0584
Schistosoma mansoni chromobox protein 0.0073 0.0417 0.0417
Echinococcus granulosus Jumonji AT rich interactive domain 1B 0.0022 0.0047 0.0038
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Onchocerca volvulus Chorion peroxidase homolog 0.0444 0.3098 0.9152
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0025 0.0073 0.0152
Brugia malayi Calcium binding EGF domain containing protein 0.0143 0.0927 0.2987
Loa Loa (eye worm) hypothetical protein 0.0019 0.0031 0.007
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Onchocerca volvulus Peroxidasin homolog 0.0444 0.3098 0.9152
Loa Loa (eye worm) latrophilin receptor protein 2 0.0032 0.0122 0.0365
Loa Loa (eye worm) hypothetical protein 0.0017 0.0017 0.0024
Entamoeba histolytica hypothetical protein 0.0035 0.0147 0.0584
Toxoplasma gondii FAD binding domain-containing protein 0.0033 0.0131 0.1319
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0186 0.0489
Loa Loa (eye worm) hypothetical protein 0.0045 0.0218 0.0675
Echinococcus multilocularis chromobox protein 1 0.0073 0.0417 0.0408
Loa Loa (eye worm) hypothetical protein 0.0023 0.006 0.0162
Brugia malayi Bromodomain containing protein 0.0038 0.0163 0.0519
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0062 0.0339 0.0339
Brugia malayi Animal haem peroxidase family protein 0.0444 0.3098 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0186 0.0571
Echinococcus granulosus cpg binding protein 0.0063 0.035 0.034
Onchocerca volvulus 0.0143 0.0927 0.2674
Brugia malayi AMP-binding enzyme family protein 0.0023 0.006 0.0184
Echinococcus granulosus protein jagged 1 0.0143 0.0927 0.0919
Schistosoma mansoni microtubule-associated protein tau 0.1399 1 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0035 0.0147 0.0137
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0305 0.2097 1
Brugia malayi EGF-like domain containing protein 0.0143 0.0927 0.2987
Schistosoma mansoni jumonji/arid domain-containing protein 0.0067 0.0373 0.0373
Echinococcus granulosus RUN 0.0019 0.0031 0.0022
Echinococcus granulosus sentrin specific protease 1 0.0046 0.0225 0.0216
Loa Loa (eye worm) hypothetical protein 0.0038 0.0164 0.0499
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.0031 0.0022
Brugia malayi chromobox protein homolog 3 0.0041 0.0186 0.0592
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0035 0.0147 0.0137
Schistosoma mansoni notch 0.0143 0.0927 0.0927
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.0323 0.341
Schistosoma mansoni myelin transcription factor 1 myt1 0.0107 0.0663 0.0663
Echinococcus granulosus slit 2 protein 0.0143 0.0927 0.0919
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0025 0.0075 0.0066
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0107 0.0663 0.0654
Echinococcus granulosus neurogenic locus notch protein 4 0.0143 0.0927 0.0919
Mycobacterium ulcerans hypothetical protein 0.0033 0.0131 0.1193
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0041 0.0186 0.0462
Onchocerca volvulus Peroxidasin homolog 0.0444 0.3098 0.9152
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0305 0.2097 0.6175
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0228 0.0727
Onchocerca volvulus 0.0306 0.2105 0.6188
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0228 0.0218
Echinococcus granulosus protein jagged 2 0.0143 0.0927 0.0919
Echinococcus granulosus neurogenic locus notch protein 0.0143 0.0927 0.0919
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Brugia malayi jmjC domain containing protein 0.0016 0.001 0.0023
Echinococcus granulosus dnaJ subfamily B 0.0829 0.5883 0.5879
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Brugia malayi jmjC domain containing protein 0.0016 0.001 0.0023
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0061 0.0335 0.0326
Schistosoma mansoni peroxidasin 0.0444 0.3098 0.3098
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.0017 0.0072
Entamoeba histolytica hypothetical protein 0.0035 0.0147 0.0584
Onchocerca volvulus 0.0023 0.006 0.0085
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0305 0.2097 0.6175
Schistosoma mansoni cpg binding protein 0.0063 0.035 0.035
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Brugia malayi Cadherin domain containing protein 0.0143 0.0927 0.2987
Trichomonas vaginalis chromobox protein, putative 0.0044 0.0208 0.0556
Chlamydia trachomatis monooxygenase 0.0033 0.0131 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0079 0.046 0.0451
Treponema pallidum fructose-bisphosphate aldolase 0.0305 0.2097 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0228 0.0228
Echinococcus multilocularis ubiquinone biosynthesis monooxygenase COQ6 0.0033 0.0131 0.0121
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0058 0.0314 0.0305
Schistosoma mansoni cell polarity protein 0.0143 0.0927 0.0927
Mycobacterium ulcerans hypothetical protein 0.0033 0.0131 0.1193
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0228 0.0218
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0094 0.0569 0.1604
Schistosoma mansoni laminin gamma-3 chain 0.0143 0.0927 0.0927
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0019 0.0026 0.0801
Onchocerca volvulus Neurogenic locus notch homolog 0.0143 0.0927 0.2674
Schistosoma mansoni ap endonuclease 0.0019 0.0026 0.0026
Schistosoma mansoni bromodomain containing protein 0.0066 0.0365 0.0365
Brugia malayi notch-like transmembrane receptor 0.0143 0.0927 0.2987
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.0323 1
Echinococcus multilocularis neurogenic locus protein delta 0.0143 0.0927 0.0919
Mycobacterium leprae possibleputative FAD-linked oxidoreductase 0.0033 0.0131 0.0781
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Schistosoma mansoni jumonji domain containing protein 0.0061 0.0335 0.0335
Brugia malayi CXXC zinc finger family protein 0.0058 0.0312 0.0999
Schistosoma mansoni hypothetical protein 0.0143 0.0927 0.0927
Loa Loa (eye worm) hypothetical protein 0.0017 0.0017 0.0024
Echinococcus granulosus lysine specific demethylase 5A 0.0067 0.0373 0.0363
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.002 0.0038 0.0028
Brugia malayi EGF-like domain containing protein 0.0143 0.0927 0.2987
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Onchocerca volvulus 0.0483 0.3382 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0032 0.0122 0.0113
Brugia malayi mbt repeat family protein 0.0094 0.0569 0.1829
Echinococcus multilocularis polycomb protein SCMH1 0.0094 0.0569 0.056
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0054 0.0283 0.0274
Schistosoma mansoni notch 0.0143 0.0927 0.0927
Schistosoma mansoni notch 0.0143 0.0927 0.0927
Echinococcus granulosus chromobox protein 1 0.0073 0.0417 0.0408
Leishmania major hypothetical protein, conserved 0.0033 0.0131 0.4052
Loa Loa (eye worm) histone methyltransferase 0.002 0.0038 0.009
Mycobacterium tuberculosis Probable oxidoreductase 0.0033 0.0131 0.1257
Schistosoma mansoni sex comb on midleg homolog 0.0094 0.0569 0.0569
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0056 0.0299 0.9262
Echinococcus multilocularis lysine specific demethylase 5A 0.0061 0.0335 0.0326
Schistosoma mansoni loxhd1 0.0019 0.0031 0.0031
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0016 0.001 0.0741
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.006 0.0516
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Brugia malayi MH2 domain containing protein 0.0124 0.0786 0.2529
Echinococcus granulosus geminin 0.0172 0.1138 0.1129
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0017 0.0012 0.0002
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Loa Loa (eye worm) hypothetical protein 0.004 0.0181 0.0554
Onchocerca volvulus Putative cubilin 0.0143 0.0927 0.2674
Mycobacterium tuberculosis Probable oxidoreductase 0.0033 0.0131 0.1257
Loa Loa (eye worm) PHD-finger family protein 0.002 0.0038 0.0091
Echinococcus multilocularis histone acetyltransferase MYST2 0.0107 0.0663 0.0654
Loa Loa (eye worm) bromodomain containing protein 0.0017 0.0017 0.0023
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0019 0.0026 0.1977
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0025 0.0073 0.0152
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.0786 0.2512
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0305 0.2097 0.6175
Brugia malayi hypothetical protein 0.0035 0.0147 0.0466
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0019 0.0026 0.0016
Onchocerca volvulus 0.0444 0.3098 0.9152
Echinococcus multilocularis chromodomain helicase DNA binding protein 4 0.0017 0.0015 0.0005
Leishmania major hypothetical protein, conserved 0.0016 0.001 0.03
Echinococcus granulosus chromodomain helicase DNA binding protein 4 0.0017 0.0015 0.0005
Loa Loa (eye worm) animal heme peroxidase 0.0444 0.3098 1
Schistosoma mansoni phosphatidylserine receptor 0.0016 0.001 0.001
Brugia malayi mbt repeat family protein 0.0094 0.0569 0.1829
Trypanosoma brucei Monooxygenase, putative 0.0033 0.0131 0.1814
Echinococcus granulosus fetal alzheimer antigen falz 0.0025 0.0075 0.0066
Brugia malayi AMP-binding enzyme family protein 0.0023 0.006 0.0184
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0017 0.0012 0.0002
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Echinococcus granulosus ubiquinone biosynthesis monooxygenase COQ6 0.0033 0.0131 0.0121
Plasmodium vivax hypothetical protein, conserved 0.0033 0.0131 0.3672
Trichomonas vaginalis conserved hypothetical protein 0.0019 0.0029 0.0021
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0062 0.0339 0.033
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.006 0.0447
Schistosoma mansoni rab6-interacting 0.0019 0.0031 0.0031
Schistosoma mansoni protein phosphatase 2C 0.0016 0.001 0.001
Echinococcus multilocularis Jumonji, AT rich interactive domain 1B 0.0022 0.0047 0.0038
Echinococcus multilocularis neurogenic locus protein delta 0.0143 0.0927 0.0919
Schistosoma mansoni hypothetical protein 0.0143 0.0927 0.0927
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0025 0.0073 0.0152
Trichomonas vaginalis conserved hypothetical protein 0.0041 0.0186 0.0489
Brugia malayi jmjC domain containing protein 0.0016 0.001 0.0023
Echinococcus multilocularis RUN 0.0019 0.0031 0.0022
Schistosoma mansoni chromodomain helicase DNA binding protein 0.0017 0.0015 0.0015
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.006 0.0164
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0228 0.0218
Trichomonas vaginalis ap endonuclease, putative 0.0019 0.0026 0.0013
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0012 0.0012
Echinococcus multilocularis neurogenic locus notch protein 0.0143 0.0927 0.0919
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0025 0.0073 0.0152
Echinococcus multilocularis protein jagged 1 0.0143 0.0927 0.0919
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0305 0.2097 1
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Brugia malayi hypothetical protein 0.0306 0.2105 0.6791
Echinococcus multilocularis protein MICAL 3 0.0033 0.0131 0.0121
Trypanosoma cruzi JmjC domain, hydroxylase, putative 0.0016 0.001 0.0741
Echinococcus granulosus Polycystic kidney disease protein 0.0019 0.0031 0.0022
Brugia malayi GCC2 and GCC3 family protein 0.0143 0.0927 0.2987
Onchocerca volvulus Neurogenic locus notch protein homolog 0.0143 0.0927 0.2674
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0305 0.2097 0.6175
Echinococcus multilocularis dnaJ subfamily B 0.0829 0.5883 0.5879
Echinococcus granulosus SAM and MBT domain containing protein 0.0094 0.0569 0.056
Echinococcus granulosus peroxidasin 0.0444 0.3098 0.3091
Echinococcus multilocularis slit 2 protein 0.0143 0.0927 0.0919
Brugia malayi AMP-binding enzyme family protein 0.0023 0.006 0.0184
Echinococcus granulosus histone acetyltransferase MYST2 0.0107 0.0663 0.0654
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0012 0.0003
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.084 0.5966 0.5962
Echinococcus multilocularis neural cadherin 0.0143 0.0927 0.0919
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.01 0.0233
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Brugia malayi Cadherin domain containing protein 0.0143 0.0927 0.2987
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Schistosoma mansoni notch 0.0143 0.0927 0.0927
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0054 0.0283 0.0274
Loa Loa (eye worm) hypothetical protein 0.0094 0.0569 0.1811
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.006 0.0447
Schistosoma mansoni sex comb on midleg homolog 0.0094 0.0569 0.0569
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Mycobacterium ulcerans FAD-linked oxidoreductase 0.0033 0.0131 0.1193
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0149 0.0969 1
Loa Loa (eye worm) blistered cuticle protein 3 0.0444 0.3098 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0305 0.2097 0.6175
Brugia malayi hypothetical protein 0.0092 0.0556 0.1788
Schistosoma mansoni hypothetical protein 0.0143 0.0927 0.0927
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0032 0.0122 0.0113
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0107 0.0663 0.0654
Loa Loa (eye worm) Notch2 0.0143 0.0927 0.2971
Leishmania major hypothetical protein, conserved 0.0033 0.0131 0.4052
Schistosoma mansoni notch 0.0143 0.0927 0.0927
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.002 0.0038 0.0028
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0025 0.0073 0.0152
Loa Loa (eye worm) hypothetical protein 0.0079 0.046 0.1459
Schistosoma mansoni hypothetical protein 0.0032 0.0122 0.0122
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0149 0.0969 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0067 0.0373 0.1175
Entamoeba histolytica hypothetical protein 0.0035 0.0147 0.0584
Mycobacterium ulcerans membrane-associated oxidoreductase 0.0033 0.0131 0.1193
Echinococcus multilocularis fat cadherin tumor suppressor 0.0143 0.0927 0.0919
Onchocerca volvulus 0.0058 0.0312 0.0838
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.0031 0.0022
Onchocerca volvulus Peroxidase homolog 0.0444 0.3098 0.9152
Echinococcus granulosus protein jagged 1 0.0143 0.0927 0.0919
Echinococcus multilocularis cpg binding protein 0.0063 0.035 0.034
Loa Loa (eye worm) hypothetical protein 0.0092 0.0556 0.177
Brugia malayi jmjC domain containing protein 0.0016 0.001 0.0023
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0079 0.046 0.046
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0012 0.0003
Echinococcus granulosus fibropellin Ia 0.0143 0.0927 0.0919
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0126 0.08 0.08
Schistosoma mansoni hypothetical protein 0.0035 0.0147 0.0147
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0323 0.0323
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.0031 0.0022
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0228 0.0218
Brugia malayi hypothetical protein 0.0444 0.3098 1
Onchocerca volvulus 0.0094 0.0569 0.1604
Trichomonas vaginalis chromobox protein, putative 0.0073 0.0417 0.1177
Brugia malayi Calcium binding EGF domain containing protein 0.0143 0.0927 0.2987
Schistosoma mansoni hypothetical protein 0.0143 0.0927 0.0927
Plasmodium falciparum sentrin-specific protease 1 0.0046 0.0225 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0305 0.2097 0.6175
Brugia malayi PHD-finger family protein 0.0028 0.0092 0.0289
Schistosoma mansoni zinc finger protein 0.0023 0.0054 0.0054
Brugia malayi EGF-like domain containing protein 0.0143 0.0927 0.2987
Brugia malayi jmjC domain containing protein 0.0067 0.0373 0.1195
Brugia malayi jmjC domain containing protein 0.0061 0.0335 0.1074
Loa Loa (eye worm) hypothetical protein 0.0032 0.0122 0.0365
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0323 0.321
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Loa Loa (eye worm) MBCTL1 0.0107 0.0663 0.2114
Echinococcus granulosus protein jagged 2 0.0143 0.0927 0.0919
Loa Loa (eye worm) hypothetical protein 0.0019 0.0031 0.007
Schistosoma mansoni hypothetical protein 0.0574 0.4038 0.4038
Brugia malayi Ulp1 protease family, C-terminal catalytic domain containing protein 0.0046 0.0225 0.0718
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0062 0.0339 0.033
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0074 0.0425 0.0425
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0228 0.0228
Mycobacterium ulcerans oxidoreductase 0.0033 0.0131 0.1193
Schistosoma mansoni hypothetical protein 0.0143 0.0927 0.0927
Mycobacterium tuberculosis Possible oxidoreductase 0.0033 0.0131 0.1257
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.006 0.0447
Brugia malayi Animal haem peroxidase family protein 0.0444 0.3098 1
Schistosoma mansoni hypothetical protein 0.0829 0.5883 0.5883
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0056 0.0299 0.0289
Echinococcus granulosus neurogenic locus notch protein 0.0143 0.0927 0.0919
Mycobacterium ulcerans oxidoreductase 0.0033 0.0131 0.1193
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0019 0.0026 0.0016
Brugia malayi EGF-like domain containing protein 0.0143 0.0927 0.2987
Schistosoma mansoni rab6-interacting 0.0019 0.0031 0.0031
Toxoplasma gondii FAD binding domain-containing protein 0.0033 0.0131 0.1319
Echinococcus multilocularis sentrin specific protease 1 0.0046 0.0225 0.0216
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0035 0.0147 0.0137
Schistosoma mansoni hypothetical protein 0.002 0.0038 0.0038
Echinococcus multilocularis microtubule associated protein 2 0.1399 1 1
Schistosoma mansoni hypothetical protein 0.0115 0.0721 0.0721
Schistosoma mansoni hypothetical protein 0.0069 0.0391 0.0391
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0228 0.0706
Loa Loa (eye worm) hypothetical protein 0.0032 0.0122 0.0365
Onchocerca volvulus 0.0143 0.0927 0.2674
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Plasmodium falciparum FAD-dependent monooxygenase, putative 0.0033 0.0131 0.562
Mycobacterium tuberculosis Possible oxidoreductase 0.0033 0.0131 0.1257
Schistosoma mansoni hypothetical protein 0.0143 0.0927 0.0927
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0373 0.2589 0.2581
Mycobacterium ulcerans hypothetical protein 0.0033 0.0131 0.1193
Brugia malayi Peroxidasin 0.0444 0.3098 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0032 0.0122 0.0113
Echinococcus multilocularis protein jagged 1 0.0143 0.0927 0.0919
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0046 0.0225 0.0225
Loa Loa (eye worm) hypothetical protein 0.0033 0.0131 0.0392
Onchocerca volvulus 0.0143 0.0927 0.2674
Onchocerca volvulus 0.0032 0.0122 0.0272
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Schistosoma mansoni cpg binding protein 0.0063 0.035 0.035
Schistosoma mansoni lipoxygenase 0.0019 0.0031 0.0031
Loa Loa (eye worm) hypothetical protein 0.0069 0.0394 0.1243
Onchocerca volvulus 0.0444 0.3098 0.9152
Plasmodium vivax acyl-CoA synthetase, putative 0.0017 0.0017 0.0227
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0425 0.296 0.9551
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0032 0.0122 0.0113
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.0323 0.0313
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Plasmodium falciparum acyl-CoA synthetase 0.0017 0.0017 0.0347
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0026 0.049
Echinococcus multilocularis neurogenic locus notch protein 0.0143 0.0927 0.0919
Brugia malayi Delta serrate ligand family protein 0.0143 0.0927 0.2987
Onchocerca volvulus Peroxidase homolog 0.0444 0.3098 0.9152
Echinococcus granulosus notch 0.0143 0.0927 0.0919
Brugia malayi CHD4 protein 0.0017 0.0015 0.0039
Toxoplasma gondii exonuclease III APE 0.0019 0.0026 0.0176
Giardia lamblia High cysteine protein 0.0143 0.0927 0.4353
Schistosoma mansoni phd/f-box containing protein 0.0016 0.001 0.001
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.006 0.0447
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Toxoplasma gondii EGF family domain-containing protein 0.0143 0.0927 1
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Trichomonas vaginalis set domain proteins, putative 0.0483 0.3382 1
Schistosoma mansoni hypothetical protein 0.0032 0.0122 0.0122
Echinococcus granulosus neurogenic locus protein delta 0.0143 0.0927 0.0919
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0056 0.0299 0.0289
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Brugia malayi EGF-like domain containing protein 0.0143 0.0927 0.2987
Loa Loa (eye worm) animal heme peroxidase 0.0444 0.3098 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.006 0.1851
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.0323 0.321
Schistosoma mansoni jumonji/arid domain-containing protein 0.0067 0.0373 0.0373
Schistosoma mansoni hypothetical protein 0.0172 0.1138 0.1138
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0044 0.0208 0.0528
Toxoplasma gondii Ulp1 protease family, C-terminal catalytic domain-containing protein 0.0046 0.0225 0.2347
Loa Loa (eye worm) hypothetical protein 0.0046 0.0225 0.0697
Echinococcus granulosus neural cadherin 0.0143 0.0927 0.0919
Schistosoma mansoni slit 0.0143 0.0927 0.0927
Schistosoma mansoni hypothetical protein 0.0172 0.1138 0.1138
Schistosoma mansoni ap endonuclease 0.0019 0.0026 0.0026
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0019 0.0026 0.075
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.006 0.0447
Schistosoma mansoni family C48 unassigned peptidase (C48 family) 0.0046 0.0225 0.0225
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0228 0.0228
Trypanosoma cruzi Monooxygenase, putative 0.0033 0.0131 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.006 0.0162
Brugia malayi Latrophilin receptor protein 2 0.0032 0.0122 0.0387
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.0323 0.3259
Brugia malayi Muscle positioning protein 4 0.0143 0.0927 0.2987
Brugia malayi Doublecortin family protein 0.0019 0.0031 0.0093
Entamoeba histolytica Ulp1 protease family, C-terminal catalytic domain containing protein 0.0046 0.0225 0.0962
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0062 0.0339 0.3592
Echinococcus multilocularis zinc finger protein 0.0023 0.0054 0.0045
Echinococcus granulosus protein MICAL 3 0.0033 0.0131 0.0121
Echinococcus multilocularis Polycystic kidney disease protein 0.0019 0.0031 0.0022
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.006 0.1851
Onchocerca volvulus 0.0444 0.3098 0.9152
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.006 0.0516
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0019 0.0026 0.0091
Loa Loa (eye worm) hypothetical protein 0.0017 0.0017 0.0024
Echinococcus multilocularis protein jagged 2 0.0143 0.0927 0.0919
Mycobacterium ulcerans hypothetical protein 0.0023 0.006 0.0447
Loa Loa (eye worm) doublecortin family protein 0.0019 0.0031 0.007
Loa Loa (eye worm) notch protein 0.0143 0.0927 0.2971
Loa Loa (eye worm) animal heme peroxidase 0.0444 0.3098 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0058 0.0312 0.0979
Trypanosoma brucei kynurenine 3-monooxygenase, putative 0.0033 0.0131 0.1814
Loa Loa (eye worm) animal heme peroxidase 0.0444 0.3098 1
Echinococcus multilocularis GPCR, family 2 0.0032 0.0122 0.0113
Brugia malayi EGF-like domain containing protein 0.0143 0.0927 0.2987
Onchocerca volvulus 0.0143 0.0927 0.2674
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0056 0.0299 0.0957
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0019 0.0026 0.1977
Wolbachia endosymbiont of Brugia malayi 2-polyprenyl-6-methoxyphenol 4-hydroxylase 0.0033 0.0131 1
Brugia malayi Animal haem peroxidase family protein 0.0444 0.3098 1
Loa Loa (eye worm) mbt repeat family protein 0.0094 0.0569 0.1811
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0025 0.0073 0.0152
Brugia malayi Blistered cuticle protein 3 0.0444 0.3098 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.006 0.0162
Plasmodium falciparum LCCL domain-containing protein 0.0019 0.0031 0.1007
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0305 0.2097 0.6175
Plasmodium vivax FAD-dependent monooxygenase, putative 0.0033 0.0131 0.3672
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0143 0.0927 0.2987
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0062 0.0339 0.033
Schistosoma mansoni transcription factor LCR-F1 0.0035 0.0147 0.0147
Schistosoma mansoni notch 0.0143 0.0927 0.0927
Brugia malayi hypothetical protein 0.0019 0.0031 0.0093
Mycobacterium ulcerans FAD-dependent oxidoreductase 0.0033 0.0131 0.1193
Echinococcus multilocularis notch 0.0143 0.0927 0.0919
Giardia lamblia Fructose-bisphosphate aldolase 0.0305 0.2097 1
Schistosoma mansoni chromobox protein 0.0073 0.0417 0.0417
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.0786 0.2512
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.006 0.0447
Echinococcus multilocularis SAM and MBT domain containing protein 0.0094 0.0569 0.056
Schistosoma mansoni eyes absent homolog 0.0092 0.0556 0.0556
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Echinococcus granulosus histone lysine methyltransferase setb 0.0079 0.046 0.0451
Onchocerca volvulus 0.0074 0.0425 0.1176
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0025 0.0073 0.0152
Brugia malayi Bromodomain containing protein 0.0077 0.0448 0.1439
Echinococcus multilocularis chromobox protein 1 0.0073 0.0417 0.0408
Schistosoma mansoni hypothetical protein 0.0032 0.0122 0.0122
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.006 0.0447
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0107 0.0663 0.2132
Echinococcus multilocularis fibropellin Ia 0.0143 0.0927 0.0919
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0149 0.0969 1
Mycobacterium tuberculosis Possible oxidoreductase 0.0033 0.0131 0.1257
Echinococcus multilocularis neurogenic locus notch protein 4 0.0143 0.0927 0.0919
Echinococcus multilocularis geminin 0.0172 0.1138 0.1129
Loa Loa (eye worm) hypothetical protein 0.0092 0.0556 0.177
Schistosoma mansoni hypothetical protein 0.0143 0.0927 0.0927
Onchocerca volvulus Slit protein homolog 0.0143 0.0927 0.2674
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.0323 0.0323
Trichomonas vaginalis chromobox protein, putative 0.0044 0.0208 0.0556
Mycobacterium ulcerans oxidoreductase GMC-type 0.0033 0.0131 0.1193
Echinococcus granulosus zinc finger protein 0.0023 0.0054 0.0045
Echinococcus granulosus mixed lineage leukemia protein mll 0.0017 0.0012 0.0002
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0056 0.0299 0.296
Brugia malayi Pre-SET motif family protein 0.0062 0.0339 0.1087
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0017 0.0012 0.0012
Trichomonas vaginalis conserved hypothetical protein 0.0029 0.01 0.0233
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0017 0.0012 0.0002
Schistosoma mansoni septate junction protein 0.0143 0.0927 0.0927
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.0323 0.0313
Brugia malayi exodeoxyribonuclease III family protein 0.0019 0.0026 0.0075
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.0031 0.0022
Entamoeba histolytica acyl-coA synthetase, putative 0.0023 0.006 0.0164
Onchocerca volvulus 0.0143 0.0927 0.2674
Trypanosoma cruzi hypothetical protein, conserved 0.0033 0.0131 1
Loa Loa (eye worm) hypothetical protein 0.0101 0.0622 0.1981
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0061 0.0335 0.0326
Schistosoma mansoni ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related 0.0016 0.001 0.001
Toxoplasma gondii histone lysine methyltransferase SET1 0.0115 0.0721 0.7754
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0019 0.0029 0.0021
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Trypanosoma brucei JmjC domain, hydroxylase, putative 0.0016 0.001 0.0134
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0101 0.0622 0.1981
Schistosoma mansoni hypothetical protein 0.0019 0.0031 0.0031
Brugia malayi Heterochromatin protein 1 0.0073 0.0417 0.1339
Plasmodium vivax sentrin-specific protease 1, putative 0.0046 0.0225 0.6534
Plasmodium vivax multidomain scavenger receptor, putative 0.0019 0.0031 0.0658
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0019 0.0026 0.0359
Loa Loa (eye worm) hypothetical protein 0.0143 0.0927 0.2971
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0019 0.0026 0.0162
Loa Loa (eye worm) hypothetical protein 0.0069 0.0391 0.1233
Loa Loa (eye worm) hypothetical protein 0.0017 0.0017 0.0024
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0373 0.2589 0.2581
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0012 0.0012
Echinococcus multilocularis peroxidasin 0.0444 0.3098 0.3091
Brugia malayi Animal haem peroxidase family protein 0.0444 0.3098 1
Brugia malayi F/Y-rich N-terminus family protein 0.0022 0.005 0.0151
Loa Loa (eye worm) CHromoDomain protein family member 0.0017 0.0015 0.0017
Schistosoma mansoni monoxygenase 0.0033 0.0131 0.0131
Onchocerca volvulus Dual oxidase homolog 0.0444 0.3098 0.9152
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0305 0.2097 0.6175
Brugia malayi latrophilin 2 splice variant baaae 0.0069 0.0391 0.1253
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0056 0.0299 0.296
Brugia malayi Animal haem peroxidase family protein 0.0444 0.3098 1
Loa Loa (eye worm) hypothetical protein 0.0444 0.3098 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0101 0.0622 0.1999
Trichomonas vaginalis Clan CE, family C48, Ulp1-like cysteine peptidase 0.0046 0.0225 0.0606
Echinococcus granulosus GPCR family 2 0.0032 0.0122 0.0113
Echinococcus granulosus polycomb protein SCMH1 0.0094 0.0569 0.056
Schistosoma mansoni hypothetical protein 0.0032 0.0122 0.0122
Loa Loa (eye worm) hypothetical protein 0.0306 0.2105 0.6784
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0032 0.0122 0.0387
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0143 0.0927 0.0927
Loa Loa (eye worm) heterochromatin protein 1 0.0073 0.0417 0.1319
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0053 0.0271 0.0847
Loa Loa (eye worm) hypothetical protein 0.0107 0.0663 0.2114
Schistosoma mansoni jumonji domain containing protein 0.0016 0.001 0.001
Echinococcus granulosus chromobox protein 1 0.0073 0.0417 0.0408
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.006 0.1851
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0101 0.0622 0.1999
Plasmodium vivax SET domain protein, putative 0.0062 0.0339 1

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 0.000000000153 M Growth response in cultures of MCF-7 (human breast cancer cell line) cells ChEMBL. 9357533
Ka (binding) = 63000000 M-1 Estrogen receptor (ER) binding affinity ChEMBL. 9357533

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 9357533

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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