Detailed information for compound 1436196

Basic information

Technical information
  • TDR Targets ID: 1436196
  • Name: 4-fluoro-N-[5-[2-(4-methoxyphenyl)sulfonyleth yl]-1,3,4-thiadiazol-2-yl]benzamide
  • MW: 421.466 | Formula: C18H16FN3O4S2
  • H donors: 1 H acceptors: 5 LogP: 2.84 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)S(=O)(=O)CCc1nnc(s1)NC(=O)c1ccc(cc1)F
  • InChi: 1S/C18H16FN3O4S2/c1-26-14-6-8-15(9-7-14)28(24,25)11-10-16-21-22-18(27-16)20-17(23)12-2-4-13(19)5-3-12/h2-9H,10-11H2,1H3,(H,20,22,23)
  • InChiKey: VGQLPKCSJBHDGW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • Oprea1_119863
  • EU-0071872
  • BAS 01892297

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens lysine (K)-specific methyltransferase 2A Starlite/ChEMBL No references
Homo sapiens multiple endocrine neoplasia I No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Neospora caninum Multidomain chromatinic protein with the following architecture: 3x PHD-bromo-3xPHD-SET domain and associated cysteine cluster a Get druggable targets OG5_130642 All targets in OG5_130642
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni hypothetical protein Get druggable targets OG5_133913 All targets in OG5_133913
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major 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
Plasmodium yoelii putative AP endonuclease-related 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
Toxoplasma gondii histone lysine methyltransferase SET1 Get druggable targets OG5_130642 All targets in OG5_130642
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum Menin, putative Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni 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
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Trichomonas vaginalis ap endonuclease, putative 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
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative 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 japonicum ko:K10771 AP endonuclease 1, putative 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 mixed-lineage leukemia protein mll Get druggable targets OG5_130642 All targets in OG5_130642
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K09188 myeloid/lymphoid or mixed-lineage leukemia protein 3, putative Get druggable targets OG5_130642 All targets in OG5_130642
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus dnaJ subfamily B Get druggable targets OG5_133913 All targets in OG5_133913
Schistosoma japonicum ko:K10772 AP endonuclease 2, 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
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 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
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
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.037 0.037
Onchocerca volvulus Dual oxidase homolog 0.0154 0.3047 1
Trichomonas vaginalis helicase, putative 0.0008 0.0067 0.1039
Mycobacterium tuberculosis Conserved protein 0.0036 0.0644 0.1394
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0644 1
Onchocerca volvulus 0.0036 0.0644 0.2113
Loa Loa (eye worm) blistered cuticle protein 3 0.0154 0.3047 0.6552
Brugia malayi Animal haem peroxidase family protein 0.0154 0.3047 0.6552
Schistosoma mansoni hypothetical protein 0.0494 1 1
Onchocerca volvulus 0.0154 0.3047 1
Echinococcus multilocularis beta LACTamase domain containing family member 0.0036 0.0644 0.0644
Toxoplasma gondii ABC1 family protein 0.0036 0.0644 0.5154
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0644 1
Schistosoma mansoni cpg binding protein 0.0035 0.0615 0.0615
Mycobacterium tuberculosis Probable lipase LipD 0.0036 0.0644 0.1394
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Mycobacterium leprae Probable lipase LipE 0.0036 0.0644 0.5
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.037 0.2944
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Loa Loa (eye worm) hypothetical protein 0.0036 0.0644 0.1384
Schistosoma mansoni hypothetical protein 0.0205 0.4088 0.4088
Brugia malayi hypothetical protein 0.0154 0.3047 0.6552
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0036 0.0644 0.1394
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Mycobacterium ulcerans esterase/lipase LipP 0.0036 0.0644 1
Schistosoma mansoni ap endonuclease 0.0023 0.037 0.037
Mycobacterium ulcerans hypothetical protein 0.0036 0.0644 1
Onchocerca volvulus Peroxidase homolog 0.0154 0.3047 1
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0082 0.0082
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.037 0.0802
Loa Loa (eye worm) histone methyltransferase 0.0011 0.0126 0.027
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.1258 1
Leishmania major hypothetical protein, conserved 0.0036 0.0644 0.5116
Schistosoma mansoni ap endonuclease 0.0023 0.037 0.037
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.0644 0.5116
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0011 0.0126 0.0126
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0644 0.0644
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0644 1
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.037 1
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0066 0.1258 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.1039
Echinococcus granulosus geminin 0.0205 0.4088 0.4088
Loa Loa (eye worm) beta-lactamase 0.0036 0.0644 0.1384
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.1039
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0082 0.0082
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.037 0.2944
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Echinococcus granulosus beta LACTamase domain containing family member 0.0036 0.0644 0.0644
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0067 0.1039
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.037 0.2944
Loa Loa (eye worm) animal heme peroxidase 0.0154 0.3047 0.6552
Trichomonas vaginalis chromodomain-helicase-DNA-binding protein, putative 0.0008 0.0067 0.1039
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.037 0.2944
Mycobacterium tuberculosis Probable lipase LipE 0.0036 0.0644 0.1394
Onchocerca volvulus 0.0154 0.3047 1
Echinococcus multilocularis transcription factor Dp 1 0.0038 0.0689 0.0689
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.037 0.5754
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.037 0.5754
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.1258 1
Mycobacterium tuberculosis Conserved protein 0.0036 0.0644 0.1394
Brugia malayi beta-lactamase family protein 0.0036 0.0644 0.1384
Loa Loa (eye worm) hypothetical protein 0.0036 0.0644 0.1384
Loa Loa (eye worm) hypothetical protein 0.0036 0.0644 0.1384
Mycobacterium tuberculosis Probable esterase LipL 0.0036 0.0644 0.1394
Brugia malayi Animal haem peroxidase family protein 0.0154 0.3047 0.6552
Loa Loa (eye worm) hypothetical protein 0.0036 0.0644 0.1384
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0066 0.1258 0.1258
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0644 0.5116
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0644 1
Loa Loa (eye worm) animal heme peroxidase 0.0154 0.3047 0.6552
Schistosoma mansoni peroxidasin 0.0154 0.3047 0.3047
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0066 0.1258 0.2706
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0644 0.5116
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0644 0.1384
Brugia malayi Animal haem peroxidase family protein 0.0154 0.3047 0.6552
Onchocerca volvulus Peroxidase homolog 0.0154 0.3047 1
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0232 0.465 1
Echinococcus granulosus mixed lineage leukemia protein mll 0.0009 0.0082 0.0082
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0231 0.4618 1
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0066 0.1258 0.2706
Onchocerca volvulus Peroxidasin homolog 0.0154 0.3047 1
Mycobacterium tuberculosis Probable hydrolase 0.0036 0.0644 0.1394
Trichomonas vaginalis D-aminoacylase, putative 0.0036 0.0644 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.037 0.2944
Onchocerca volvulus Peroxidasin homolog 0.0154 0.3047 1
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0066 0.1258 0.1258
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.037 0.037
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Echinococcus multilocularis cpg binding protein 0.0037 0.0655 0.0655
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0644 0.5
Echinococcus granulosus cpg binding protein 0.0037 0.0655 0.0655
Mycobacterium ulcerans lipase LipD 0.0036 0.0644 1
Mycobacterium tuberculosis Conserved protein 0.0036 0.0644 0.1394
Onchocerca volvulus Chorion peroxidase homolog 0.0154 0.3047 1
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.1039
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.037 1
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0036 0.0644 0.1394
Toxoplasma gondii histone lysine methyltransferase SET1 0.0066 0.1249 1
Brugia malayi Animal haem peroxidase family protein 0.0154 0.3047 0.6552
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0036 0.0644 0.0644
Brugia malayi F/Y-rich N-terminus family protein 0.0011 0.0123 0.0264
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.037 0.0797
Mycobacterium ulcerans beta-lactamase 0.0036 0.0644 1
Loa Loa (eye worm) animal heme peroxidase 0.0154 0.3047 0.6552
Loa Loa (eye worm) hypothetical protein 0.0036 0.0644 0.1384
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0036 0.0644 0.1394
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0036 0.0644 1
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Schistosoma mansoni hypothetical protein 0.0205 0.4088 0.4088
Onchocerca volvulus 0.0036 0.0644 0.2113
Onchocerca volvulus 0.0036 0.0644 0.2113
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Brugia malayi Animal haem peroxidase family protein 0.0154 0.3047 0.6552
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.1039
Brugia malayi follicle stimulating hormone receptor 0.0232 0.465 1
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Brugia malayi Blistered cuticle protein 3 0.0154 0.3047 0.6552
Trichomonas vaginalis conserved hypothetical protein 0.0008 0.0067 0.1039
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Brugia malayi Peroxidasin 0.0154 0.3047 0.6552
Toxoplasma gondii exonuclease III APE 0.0023 0.037 0.2966
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.037 0.5
Echinococcus granulosus transcription factor Dp 1 0.0038 0.0689 0.0689
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.037 0.0797
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Loa Loa (eye worm) hypothetical protein 0.0154 0.3047 0.6552
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0074 0.141 0.141
Echinococcus granulosus peroxidasin 0.0154 0.3047 0.3047
Trichomonas vaginalis esterase, putative 0.0036 0.0644 1
Brugia malayi beta-lactamase 0.0036 0.0644 0.1384
Brugia malayi CXXC zinc finger family protein 0.0035 0.0615 0.1323
Onchocerca volvulus 0.0035 0.0615 0.2018
Echinococcus multilocularis peroxidasin 0.0154 0.3047 0.3047
Trichomonas vaginalis penicillin-binding protein, putative 0.0036 0.0644 1
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.037 1
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0644 0.1384
Schistosoma mansoni cpg binding protein 0.0037 0.0655 0.0655
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0066 0.1258 0.1258
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0005 0.0008 0.0008
Onchocerca volvulus 0.0154 0.3047 1
Loa Loa (eye worm) CXXC zinc finger family protein 0.0035 0.0615 0.1323
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0009 0.0082 0.0082
Echinococcus multilocularis dnaJ subfamily B 0.0494 1 1
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0066 0.1258 1
Echinococcus multilocularis geminin 0.0205 0.4088 0.4088
Brugia malayi beta-lactamase family protein 0.0036 0.0644 0.1384
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.1039
Loa Loa (eye worm) animal heme peroxidase 0.0154 0.3047 0.6552
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0011 0.0126 0.0126
Schistosoma mansoni peroxidasin 0.0154 0.3047 0.3047
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0066 0.1258 1
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.037 0.5754
Echinococcus multilocularis mixed lineage leukemia protein mll 0.0009 0.0082 0.0082
Schistosoma mansoni cpg binding protein 0.0037 0.0655 0.0655
Loa Loa (eye worm) hypothetical protein 0.0036 0.0644 0.1384
Trichomonas vaginalis chromodomain helicase DNA binding protein, putative 0.0008 0.0067 0.1039

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.2378 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (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 SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 19.9526 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 25.1189 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 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) 50.1187 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] 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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