Detailed information for compound 1280040

Basic information

Technical information
  • TDR Targets ID: 1280040
  • Name: 4-chloro-N-(2-pyrimidin-2-ylsulfanylcyclohexy l)benzenesulfonamide
  • MW: 383.916 | Formula: C16H18ClN3O2S2
  • H donors: 1 H acceptors: 4 LogP: 3.67 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(cc1)S(=O)(=O)NC1CCCCC1Sc1ncccn1
  • InChi: 1S/C16H18ClN3O2S2/c17-12-6-8-13(9-7-12)24(21,22)20-14-4-1-2-5-15(14)23-16-18-10-3-11-19-16/h3,6-11,14-15,20H,1-2,4-5H2
  • InChiKey: LMRZAQUSULQHAW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-chloro-N-[2-(2-pyrimidinylthio)cyclohexyl]benzenesulfonamide
  • 4-chloro-N-[2-(pyrimidin-2-ylthio)cyclohexyl]benzenesulfonamide
  • 4-Chloro-N-[2-(pyrimidin-2-ylsulfanyl)-cyclohexyl]-benzenesulfonamide
  • BAS 03787143
  • MLS000555082
  • SMR000172252
  • UNM000000650601
  • STOCK2S-83121

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens thyroid hormone receptor, beta Starlite/ChEMBL No references
Homo sapiens aldehyde dehydrogenase 1 family, member A1 Starlite/ChEMBL No references
Homo sapiens K(lysine) acetyltransferase 2A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus granulosus aldehyde dehydrogenase mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium falciparum histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum Thyroid hormone receptor alpha, putative Get druggable targets OG5_134830 All targets in OG5_134830
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K06062 p300/CBP-associated factor, putative Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium knowlesi histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania donovani aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium tuberculosis Probable aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K08362 nuclear receptor, subfamily 1, group A, member 2, putative Get druggable targets OG5_134830 All targets in OG5_134830
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K00128 aldehyde dehydrogenase (NAD+) [EC1.2.1.3], putative Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum Bromodomain containing protein, related Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum expressed protein Get druggable targets OG5_134830 All targets in OG5_134830
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative Get druggable targets OG5_127781 All targets in OG5_127781
Toxoplasma gondii histone lysine acetyltransferase GCN5-B Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Aldehyde dehydrogenase X, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Cryptosporidium hominis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium yoelii histone acetyltransferase GCN5-related Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva histone acetyltransferase Gcn5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal Get druggable targets OG5_134830 All targets in OG5_134830
Entamoeba histolytica acetyltransferase, GNAT family Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis bromodomain-containing protein, putative Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania infantum aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi acetyltransferase, GNAT family protein Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Babesia bovis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Toxoplasma gondii histone lysine acetyltransferase GCN5-A Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal Get druggable targets OG5_134830 All targets in OG5_134830
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni hypothetical protein Get druggable targets OG5_134830 All targets in OG5_134830
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis thyroid hormone receptor alpha Get druggable targets OG5_134830 All targets in OG5_134830
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Thyroid hormone receptor alpha, putative Get druggable targets OG5_134830 All targets in OG5_134830
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Aldehyde dehydrogenase, mitochondrial precursor, putative Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_127781 All targets in OG5_127781
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium vivax histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma mansoni thyroid hormone receptor Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma mansoni aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Neospora caninum hypothetical protein Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans Mitochondrial aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Schistosoma japonicum Retinal dehydrogenase 1, putative Get druggable targets OG5_126638 All targets in OG5_126638
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana aldehyde dehydrogenase, mitochondrial precursor Get druggable targets OG5_126638 All targets in OG5_126638
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Mycobacterium ulcerans aldehyde dehydrogenase Get druggable targets OG5_126638 All targets in OG5_126638
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial Get druggable targets OG5_126638 All targets in OG5_126638
Cryptosporidium parvum GCN5 like acetylase + bromodomain Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma mansoni thyroid hormone receptor Get druggable targets OG5_134830 All targets in OG5_134830
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi photoreceptor-specific nuclear receptor thyroid hormone receptor, beta 461 aa 414 aa 24.6 %
Mycobacterium tuberculosis Succinate-semialdehyde dehydrogenase [NADP+] dependent (SSDH) GabD1 aldehyde dehydrogenase 1 family, member A1 501 aa 456 aa 33.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0892 0.0971
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0468 0.5
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0468 0.0468
Entamoeba histolytica acetyltransferase, GNAT family 0.0047 0.1868 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0513 0.0558
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0023 0.0513 0.0463
Loa Loa (eye worm) hypothetical protein 0.0023 0.0513 0.0558
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0468 0.5
Schistosoma mansoni lamin 0.003 0.0892 0.0445
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0023 0.0513 0.0558
Echinococcus granulosus FTZ F1 alpha 0.0023 0.0513 0.0513
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0023 0.0513 0.0513
Loa Loa (eye worm) hypothetical protein 0.0023 0.0513 0.0558
Brugia malayi photoreceptor-specific nuclear receptor 0.0023 0.0513 0.0463
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0073 0.3365 1
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0175 0.9185 0.9185
Loa Loa (eye worm) acetyltransferase 0.0175 0.9185 1
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0051 0.2114 0.5682
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0023 0.0513 0.0513
Loa Loa (eye worm) hypothetical protein 0.0023 0.0513 0.0558
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0023 0.0513 0.0513
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0023 0.0513 0.0558
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0073 0.3365 0.3365
Brugia malayi steroid hormone receptor 0.0023 0.0513 0.0463
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0023 0.0513 0.0463
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0023 0.0513 0.0463
Echinococcus granulosus ecdysone induced protein 78C 0.0023 0.0513 0.0513
Onchocerca volvulus 0.003 0.0892 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0023 0.0513 0.0513
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0023 0.0513 0.0463
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0016 0.0092 0.01
Loa Loa (eye worm) hypothetical protein 0.0023 0.0513 0.0558
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0023 0.0513 0.0463
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0023 0.0513 0.0047
Echinococcus multilocularis ecdysone induced protein 78C 0.0023 0.0513 0.0513
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0468 0.0468
Giardia lamblia Histone acetyltransferase GCN5 0.0047 0.1868 1
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0152 0.7869 0.7869
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0023 0.0513 0.0463
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0892 0.088
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0023 0.0513 0.0463
Brugia malayi nuclear receptor NHR-88 0.0023 0.0513 0.0463
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0152 0.7869 0.7869
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0023 0.0513 0.0558
Schistosoma mansoni lamin 0.003 0.0892 0.0445
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0023 0.0513 0.0463
Brugia malayi Nuclear hormone receptor-like 1 0.0023 0.0513 0.0463
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0023 0.0513 0.0558
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0023 0.0513 0.0047
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0023 0.0513 0.0047
Brugia malayi Steroid receptor seven-up type 2 0.0023 0.0513 0.0463
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.3365 0.3039
Echinococcus multilocularis geminin 0.0189 1 1
Trichomonas vaginalis bromodomain-containing protein, putative 0.0051 0.2114 1
Echinococcus multilocularis lamin 0.003 0.0892 0.0892
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0023 0.0513 0.0513
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0023 0.0513 0.0047
Schistosoma mansoni steroid hormone receptor ad4bp 0.0023 0.0513 0.0047
Toxoplasma gondii aldehyde dehydrogenase 0.0073 0.3365 1
Schistosoma mansoni hypothetical protein 0.0189 1 1
Echinococcus multilocularis musashi 0.003 0.0892 0.0892
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0468 0.5
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0023 0.0513 0.0047
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0051 0.2114 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0023 0.0513 0.0513
Schistosoma mansoni aldehyde dehydrogenase 0.0073 0.3365 0.3039
Echinococcus granulosus histone acetyltransferase KAT2B 0.0051 0.2114 0.2114
Loa Loa (eye worm) intermediate filament protein 0.003 0.0892 0.0971
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0073 0.3365 0.3365
Loa Loa (eye worm) steroid hormone receptor 0.0023 0.0513 0.0558
Schistosoma mansoni RAR-like nuclear receptor 0.0023 0.0513 0.0047
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0468 0.0414
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0023 0.0513 0.0047
Loa Loa (eye worm) hypothetical protein 0.0023 0.0513 0.0558
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0023 0.0513 0.0558
Echinococcus granulosus lamin 0.003 0.0892 0.0892
Echinococcus granulosus histone acetyltransferase KAT2B 0.017 0.8904 0.8904
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0023 0.0513 0.0463
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0023 0.0513 0.0558
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0023 0.0513 0.0513
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.3365 1
Brugia malayi nuclear hormone receptor 0.0023 0.0513 0.0463
Echinococcus multilocularis FTZ F1 alpha 0.0023 0.0513 0.0513
Loa Loa (eye worm) hypothetical protein 0.003 0.086 0.0937
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0023 0.0513 0.0463
Echinococcus multilocularis lamin dm0 0.003 0.0892 0.0892
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0468 0.5
Schistosoma mansoni thyroid hormone receptor 0.0176 0.9213 0.9175
Plasmodium falciparum histone acetyltransferase GCN5 0.0047 0.1868 1
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0073 0.3365 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0023 0.0513 0.0463
Schistosoma mansoni coup transcription factor 0.0023 0.0513 0.0047
Brugia malayi ecdysteroid receptor 0.0023 0.0513 0.0463
Brugia malayi intermediate filament protein 0.003 0.0892 0.088
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0023 0.0513 0.0513
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0468 0.0509
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0051 0.2114 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0175 0.9185 0.9145
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.3365 1
Brugia malayi acetyltransferase, GNAT family protein 0.0175 0.9185 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0023 0.0513 0.0463
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0023 0.0513 0.0513
Loa Loa (eye worm) hypothetical protein 0.0023 0.0513 0.0558
Onchocerca volvulus 0.003 0.0892 1
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0023 0.0513 0.0513
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0023 0.0513 0.0513
Schistosoma mansoni intermediate filament proteins 0.003 0.0892 0.0445
Schistosoma mansoni hypothetical protein 0.0152 0.7869 0.7764
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0023 0.0513 0.0558
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0023 0.0513 0.0513
Mycobacterium ulcerans aldehyde dehydrogenase 0.0073 0.3365 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0023 0.0513 0.0463
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0468 0.5
Schistosoma mansoni retinoic acid receptor RXR 0.0023 0.0513 0.0047
Schistosoma mansoni nuclear hormone receptor 0.0023 0.0513 0.0047
Echinococcus granulosus lamin dm0 0.003 0.0892 0.0892
Schistosoma mansoni thyroid hormone receptor 0.0176 0.9213 0.9175
Echinococcus multilocularis thyroid hormone receptor alpha 0.0176 0.9213 0.9213
Echinococcus granulosus intermediate filament protein 0.003 0.0892 0.0892
Loa Loa (eye worm) hypothetical protein 0.0023 0.0513 0.0558
Loa Loa (eye worm) hypothetical protein 0.003 0.0892 0.0971
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0051 0.2114 0.5682
Schistosoma mansoni hypothetical protein 0.0189 1 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0023 0.0513 0.0513

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 2.2387 um PUBCHEM_BIOASSAY: Total Fluorescence Counterscreen for Inhibitors of the Interaction of Thyroid Hormone Receptor and Steroid Receptor Coregulator 2. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.9811 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 8.9125 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of GCN5L2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504398] ChEMBL. No reference
Potency (functional) 12.5893 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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