Detailed information for compound 1233676

Basic information

Technical information
  • TDR Targets ID: 1233676
  • Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] (E)-3- [4-(diethylsulfamoyl)phenyl]prop-2-enoate
  • MW: 420.479 | Formula: C20H24N2O6S
  • H donors: 1 H acceptors: 4 LogP: 2.02 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(S(=O)(=O)c1ccc(cc1)/C=C/C(=O)OCC(=O)NCc1ccco1)CC
  • InChi: 1S/C20H24N2O6S/c1-3-22(4-2)29(25,26)18-10-7-16(8-11-18)9-12-20(24)28-15-19(23)21-14-17-6-5-13-27-17/h5-13H,3-4,14-15H2,1-2H3,(H,21,23)/b12-9+
  • InChiKey: NLJJPUCGRDMEMV-FMIVXFBMSA-N  


Substructure search Similarity search

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Synonyms

  • [2-(furan-2-ylmethylamino)-2-oxoethyl] 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate
  • [2-(2-furylmethylamino)-2-oxo-ethyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate
  • [2-(2-furylmethylamino)-2-oxo-ethyl] 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate
  • (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoic acid [2-(2-furylmethylamino)-2-oxoethyl] ester
  • 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoic acid [2-(2-furylmethylamino)-2-oxoethyl] ester
  • (E)-3-[4-(diethylsulfamoyl)phenyl]acrylic acid [2-(2-furylmethylamino)-2-keto-ethyl] ester
  • 3-[4-(diethylsulfamoyl)phenyl]acrylic acid [2-(2-furylmethylamino)-2-keto-ethyl] ester
  • [2-(furan-2-ylmethylamino)-2-oxo-ethyl] (E)-3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate
  • [2-(furan-2-ylmethylamino)-2-oxo-ethyl] 3-[4-(diethylsulfamoyl)phenyl]prop-2-enoate
  • ZINC03239751
  • T0509-1759

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Trypanosoma brucei gambiense ATP-dependent phosphofructokinase,6-phospho-1-fructokinase No references
Homo sapiens Werner syndrome, RecQ helicase-like Starlite/ChEMBL No references
Homo sapiens polymerase (DNA directed), eta Starlite/ChEMBL No references
Homo sapiens l(3)mbt-like 1 (Drosophila) Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 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
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Loa Loa (eye worm) 6-phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis dna polymerase eta Get druggable targets OG5_128521 All targets in OG5_128521
Trypanosoma cruzi DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Brugia malayi 6-phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis bromodomain-containing protein, putative Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania infantum DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal Get druggable targets OG5_126758 All targets in OG5_126758
Giardia lamblia Histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Entamoeba histolytica acetyltransferase, GNAT family Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania mexicana 6-phospho-1-fructokinase, putative Get druggable targets OG5_126758 All targets in OG5_126758
Trichomonas vaginalis phosphofructokinase, putative Get druggable targets OG5_126758 All targets in OG5_126758
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis 6 phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Neospora caninum hypothetical protein Get druggable targets OG5_127781 All targets in OG5_127781
Entamoeba histolytica phosphofructokinase, putative Get druggable targets OG5_126758 All targets in OG5_126758
Toxoplasma gondii ImpB/MucB/SamB family protein Get druggable targets OG5_128521 All targets in OG5_128521
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03509 DNA polymerase eta subunit, putative Get druggable targets OG5_128521 All targets in OG5_128521
Leishmania mexicana Get druggable targets OG5_128521 All targets in OG5_128521
Mycobacterium ulcerans 6-phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma japonicum Lethal(3)malignant brain tumor-like 3 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania braziliensis DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Plasmodium yoelii histone acetyltransferase GCN5-related Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA polymerase eta Get druggable targets OG5_128521 All targets in OG5_128521
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense ATP-dependent phosphofructokinase,6-phospho-1-fructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Candida albicans phosphofructokinase beta-subunit that can functionally substitute for S. cerevisiae PFK2 (YMR205C) Get druggable targets OG5_126758 All targets in OG5_126758
Brugia malayi ImpB/MucB/SamB family protein Get druggable targets OG5_128521 All targets in OG5_128521
Trypanosoma brucei gambiense DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica phosphofructokinase, putative Get druggable targets OG5_126758 All targets in OG5_126758
Trypanosoma brucei DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Plasmodium falciparum histone acetyltransferase GCN5 Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis phosphofructokinase, putative Get druggable targets OG5_126758 All targets in OG5_126758
Echinococcus multilocularis endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans hypothetical protein Get druggable targets OG5_126758 All targets in OG5_126758
Leishmania braziliensis DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) Get druggable targets OG5_126758 All targets in OG5_126758
Neospora caninum Bromodomain containing protein, related Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal Get druggable targets OG5_126758 All targets in OG5_126758
Echinococcus granulosus dna polymerase eta Get druggable targets OG5_128521 All targets in OG5_128521
Trypanosoma cruzi DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Theileria parva histone acetyltransferase Gcn5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans phosphofructokinase beta-subunit that can functionally substitute for S. cerevisiae PFK2 (YMR205C) Get druggable targets OG5_126758 All targets in OG5_126758
Toxoplasma gondii histone lysine acetyltransferase GCN5-A Get druggable targets OG5_127781 All targets in OG5_127781
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium parvum GCN5 like acetylase + bromodomain Get druggable targets OG5_127781 All targets in OG5_127781
Echinococcus granulosus endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major ATP-dependent phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Schistosoma japonicum ko:K06062 p300/CBP-associated factor, putative Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128521 All targets in OG5_128521
Leishmania infantum DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) 6-phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) Get druggable targets OG5_126758 All targets in OG5_126758
Schistosoma mansoni hypothetical protein Get druggable targets OG5_130415 All targets in OG5_130415
Plasmodium knowlesi histone acetyltransferase GCN5, putative 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
Schistosoma mansoni 6-phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Echinococcus granulosus 6 phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Entamoeba histolytica phosphofructokinase, putative Get druggable targets OG5_126758 All targets in OG5_126758
Brugia malayi acetyltransferase, GNAT family protein Get druggable targets OG5_127781 All targets in OG5_127781
Candida albicans phosphofructokinase alpha subunit that can functionally substitute for S. cerevisiae PFK1 (YGR240C) Get druggable targets OG5_126758 All targets in OG5_126758
Loa Loa (eye worm) phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Brugia malayi 6-phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Schistosoma mansoni 6-phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania braziliensis ATP-dependent phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii histone lysine acetyltransferase GCN5-B Get druggable targets OG5_127781 All targets in OG5_127781
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 Get druggable targets OG5_127781 All targets in OG5_127781
Trichomonas vaginalis phosphofructokinase, putative Get druggable targets OG5_126758 All targets in OG5_126758
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium vivax histone acetyltransferase GCN5, putative 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
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase Get druggable targets OG5_126758 All targets in OG5_126758
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis Get druggable targets OG5_127781 All targets in OG5_127781
Plasmodium berghei histone acetyltransferase GCN5, putative Get druggable targets OG5_127781 All targets in OG5_127781
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans similar to S. cerevisiae DNA polymerase pol-eta, involved in the bypass of distorted DNA lesions Get druggable targets OG5_128521 All targets in OG5_128521
Trichomonas vaginalis phosphofructokinase, putative Get druggable targets OG5_126758 All targets in OG5_126758
Leishmania major DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum ATP-dependent phosphofructokinase Get druggable targets OG5_126758 All targets in OG5_126758
Trypanosoma congolense ATP-dependent 6-phosphofructokinase, glycosomal Get druggable targets OG5_126758 All targets in OG5_126758
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans bromodomain protein similar to S. cerevisiae GCN5 (YGR252W) histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani ATP-dependent 6-phosphofructokinase, glycosomal Get druggable targets OG5_126758 All targets in OG5_126758
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Lethal(3)malignant brain tumor-like 4 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Candida albicans phosphofructokinase alpha subunit that can functionally substitute for S. cerevisiae PFK1 (YGR240C) Get druggable targets OG5_126758 All targets in OG5_126758
Echinococcus granulosus histone acetyltransferase KAT2B Get druggable targets OG5_127781 All targets in OG5_127781
Cryptosporidium parvum DinB/family X-type DNA polymerase Get druggable targets OG5_128521 All targets in OG5_128521
Babesia bovis histone acetyltransferase Get druggable targets OG5_127781 All targets in OG5_127781
Leishmania major DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03509 DNA polymerase eta subunit, putative Get druggable targets OG5_128521 All targets in OG5_128521
Trypanosoma congolense DNA polymerase eta, putative Get druggable targets OG5_128521 All targets in OG5_128521
Neospora caninum Pc21g17280 protein, related Get druggable targets OG5_128521 All targets in OG5_128521
Candida albicans similar to S. cerevisiae DNA polymerase pol-eta, involved in the bypass of distorted DNA lesions Get druggable targets OG5_128521 All targets in OG5_128521
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative Get druggable targets OG5_127781 All targets in OG5_127781
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K00850 6-phosphofructokinase [EC2.7.1.11], putative Get druggable targets OG5_126758 All targets in OG5_126758
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Toxoplasma gondii phosphofructokinase PFKII 0.0035 0.0853 0.6472
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0051 0.1319 0.3108
Giardia lamblia Sgs1 DNA helicase, putative 0.0012 0.0171 0.1185
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0853 0.1725
Trypanosoma brucei unspecified product 0.0023 0.05 0.1296
Echinococcus granulosus dna polymerase kappa 0.0023 0.05 0.0527
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0131 0.3638 1
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.05 0.1296
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0853 0.1725
Echinococcus multilocularis histone acetyltransferase MYST2 0.0066 0.1729 0.2493
Echinococcus granulosus polycomb protein SCMH1 0.0058 0.1497 0.2122
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.05 0.1296
Loa Loa (eye worm) RecQ helicase 0.0029 0.0665 0.1297
Onchocerca volvulus 0.0058 0.1497 0.5
Brugia malayi ImpB/MucB/SamB family protein 0.0054 0.1394 0.2791
Brugia malayi Bloom's syndrome protein homolog 0.0029 0.0665 0.1297
Entamoeba histolytica phosphofructokinase, putative 0.0131 0.3638 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.029 0.0713
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.1497 0.1497
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0273 0.0665
Trichomonas vaginalis phosphofructokinase, putative 0.0131 0.3638 1
Loa Loa (eye worm) acetyltransferase 0.0175 0.491 1
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0171 0.1293
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0171 0.0282
Schistosoma mansoni hypothetical protein 0.0205 0.577 0.577
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0012 0.0171 0.0282
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0038 0.0927 0.703
Plasmodium falciparum histone acetyltransferase GCN5 0.0047 0.1194 1
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0131 0.3638 1
Entamoeba histolytica acetyltransferase, GNAT family 0.0047 0.1194 0.3282
Giardia lamblia DINP protein human, muc B family 0.0023 0.05 0.4023
Entamoeba histolytica phosphofructokinase, putative 0.0131 0.3638 1
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0066 0.1729 0.2493
Giardia lamblia Histone acetyltransferase GCN5 0.0047 0.1194 1
Entamoeba histolytica recQ family helicase, putative 0.0015 0.0273 0.075
Trypanosoma brucei DNA polymerase eta, putative 0.0054 0.1394 0.3776
Echinococcus multilocularis polycomb protein SCMH1 0.0058 0.1497 0.2122
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.05 0.1296
Echinococcus multilocularis bloom syndrome protein 0.0029 0.0665 0.0792
Echinococcus granulosus histone acetyltransferase KAT2B 0.017 0.4767 0.7355
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0012 0.0171 0.1185
Leishmania major ATP-dependent phosphofructokinase 0.0131 0.3638 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0051 0.1319 0.1837
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.1497 0.1497
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0058 0.1497 0.5
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.002 0.0392 0.2796
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0035 0.0853 0.7066
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0035 0.0853 0.6472
Brugia malayi mbt repeat family protein 0.0058 0.1497 0.3002
Brugia malayi 6-phosphofructokinase 0.0131 0.3638 0.7392
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0025 0.0563 0.4565
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Schistosoma mansoni 6-phosphofructokinase 0.0131 0.3638 0.3638
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0273 0.0665
Loa Loa (eye worm) 6-phosphofructokinase 0.0131 0.3638 0.7392
Loa Loa (eye worm) MBCTL1 0.0066 0.1729 0.3477
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0023 0.05 0.0527
Brugia malayi acetyltransferase, GNAT family protein 0.0175 0.491 1
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0035 0.0853 0.5
Loa Loa (eye worm) hypothetical protein 0.0058 0.1497 0.3002
Loa Loa (eye worm) 6-phosphofructokinase 0.0131 0.3638 0.7392
Entamoeba histolytica phosphofructokinase, putative 0.0131 0.3638 1
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.05 0.1296
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0051 0.1319 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Echinococcus multilocularis dna polymerase eta 0.0054 0.1394 0.1958
Echinococcus granulosus 6 phosphofructokinase 0.0131 0.3638 0.5548
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.029 0.0713
Echinococcus granulosus geminin 0.0205 0.577 0.896
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0171 0.0282
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0853 0.1725
Trichomonas vaginalis DNA polymerase eta, putative 0.0023 0.05 0.0675
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0023 0.05 0.0527
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0386 0.2925
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0035 0.0853 0.7066
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0066 0.1729 0.3477
Echinococcus multilocularis dna polymerase kappa 0.0023 0.05 0.0527
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0035 0.0853 0.7066
Loa Loa (eye worm) hypothetical protein 0.0066 0.1729 0.3477
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Echinococcus granulosus histone acetyltransferase MYST2 0.0066 0.1729 0.2493
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.05 0.1296
Echinococcus multilocularis geminin 0.0205 0.577 0.896
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0023 0.05 0.05
Echinococcus multilocularis SAM and MBT domain containing protein 0.0058 0.1497 0.2122
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Brugia malayi mbt repeat family protein 0.0058 0.1497 0.3002
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0035 0.0853 0.1725
Trichomonas vaginalis phosphofructokinase, putative 0.0131 0.3638 1
Loa Loa (eye worm) hypothetical protein 0.0054 0.1394 0.2791
Loa Loa (eye worm) phosphofructokinase 0.0131 0.3638 0.7392
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0853 0.1725
Schistosoma mansoni terminal deoxycytidyl transferase 0.0023 0.05 0.05
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0171 0.1293
Loa Loa (eye worm) hypothetical protein 0.0012 0.0171 0.0282
Schistosoma mansoni 6-phosphofructokinase 0.0131 0.3638 0.3638
Echinococcus granulosus bloom syndrome protein 0.0029 0.0665 0.0792
Schistosoma mansoni DNA polymerase IV / kappa 0.0007 0.0033 0.0033
Brugia malayi phosphofructokinase 0.0131 0.3638 0.7392
Leishmania major DNA polymerase eta, putative 0.0038 0.0927 0.248
Echinococcus granulosus dna polymerase eta 0.0054 0.1394 0.1958
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.05 0.1296
Schistosoma mansoni DNA helicase recq1 0.0012 0.0171 0.0171
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0035 0.0853 0.2346
Trypanosoma cruzi DNA polymerase eta, putative 0.0038 0.0927 0.248
Trypanosoma cruzi DNA polymerase kappa, putative 0.0023 0.05 0.1296
Echinococcus granulosus SAM and MBT domain containing protein 0.0058 0.1497 0.2122
Trichomonas vaginalis bromodomain-containing protein, putative 0.0051 0.1319 0.3108
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0007 0.0033 0.025
Brugia malayi ImpB/MucB/SamB family protein 0.0023 0.05 0.0958
Echinococcus multilocularis 6 phosphofructokinase 0.0131 0.3638 0.5548
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0051 0.1319 1
Mycobacterium ulcerans DNA polymerase IV 0.0023 0.05 0.1296
Plasmodium vivax 6-phosphofructokinase, putative 0.0035 0.0853 0.6381
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0051 0.1319 1
Trichomonas vaginalis phosphofructokinase, putative 0.0131 0.3638 1
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0175 0.491 0.7583
Loa Loa (eye worm) mbt repeat family protein 0.0058 0.1497 0.3002
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0273 0.0665
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0131 0.3638 1
Mycobacterium ulcerans 6-phosphofructokinase 0.0131 0.3638 1
Leishmania major DNA polymerase kappa, putative 0.0023 0.05 0.1296
Loa Loa (eye worm) hypothetical protein 0.0146 0.4064 0.8265
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0066 0.1729 0.2493
Schistosoma mansoni DNA helicase recq5 0.0012 0.0171 0.0171
Brugia malayi 6-phosphofructokinase 0.0131 0.3638 0.7392
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0853 0.1725
Trypanosoma brucei unspecified product 0.0016 0.029 0.0713
Trypanosoma brucei DNA polymerase IV, putative 0.0023 0.05 0.1296
Plasmodium vivax 6-phosphofructokinase, putative 0.0035 0.0853 0.6381
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0227 0.642 1
Trypanosoma cruzi DNA polymerase eta, putative 0.0054 0.1394 0.3776
Trichomonas vaginalis DNA helicase recq1, putative 0.0029 0.0665 0.1166
Trypanosoma brucei DNA polymerase kappa, putative 0.0016 0.029 0.0713
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Trichomonas vaginalis phosphofructokinase, putative 0.0131 0.3638 1
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0227 0.642 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Trichomonas vaginalis DNA helicase recq, putative 0.0029 0.0665 0.1166
Toxoplasma gondii 6-phosphofructokinase 0.0035 0.0853 0.6472
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0058 0.1497 0.1497
Schistosoma mansoni hypothetical protein 0.0205 0.577 0.577
Trypanosoma brucei DNA polymerase kappa, putative 0.0023 0.05 0.1296
Schistosoma mansoni blooms syndrome DNA helicase 0.0023 0.0488 0.0488
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0023 0.05 0.1296
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0035 0.0853 0.5
Leishmania major DNA polymerase eta, putative 0.0054 0.1394 0.3776
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0007 0.0033 0.025
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0023 0.05 0.0675
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0175 0.491 0.491
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0131 0.3638 1
Trichomonas vaginalis phosphofructokinase, putative 0.0035 0.0853 0.1725
Schistosoma mansoni myelin transcription factor 1 myt1 0.0066 0.1729 0.1729
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0131 0.3638 0.5
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0023 0.05 0.0958
Trypanosoma brucei unspecified product 0.0016 0.029 0.0713
Schistosoma mansoni DNA polymerase eta 0.0054 0.1394 0.1394
Entamoeba histolytica deoxycytidyl transferase, putative 0.0023 0.05 0.1375

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 3.1623 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of GCN5L2. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504398] ChEMBL. No reference
Potency (functional) 11.9955 uM PUBCHEM_BIOASSAY: qHTS Assay to Find Inhibitors of T. brucei phosphofructokinase. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488768, AID492961] ChEMBL. No reference
Potency (functional) 15.8489 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Eta. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588636] ChEMBL. No reference
Potency (functional) 15.8489 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 18.3564 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 19.9526 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of L3MBTL1. (Class of assay: confirmatory) [Related pubchem assays: 485292 (Probe Development Summary for Inhibitors of L3MBTL1)] ChEMBL. No reference
Potency (functional) 29.9349 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 31.6228 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) = 35.4813 um PUBCHEM_BIOASSAY: qHTS Assay for Identifying a Potential Treatment of Ataxia-Telangiectasia. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference
Potency (functional) 42.2841 uM PubChem BioAssay. qHTS for Inhibitors of Polymerase Kappa: Confirmatory Assay for Cherry-picked Compounds. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 44.6684 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Tyrosyl-DNA Phosphodiesterase (TDP1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] ChEMBL. No reference
Potency (functional) 50.1187 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] ChEMBL. No reference
Potency (functional) 56.2341 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Kappa. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588638] ChEMBL. No reference
Potency (functional) 75.6863 uM PubChem BioAssay. qHTS for Inhibitors of Polymerase Eta: Confirmatory Assay for Cherry-picked Compounds. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 84.9214 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference

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.
 
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.

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