Detailed information for compound 1481107

Basic information

Technical information
  • TDR Targets ID: 1481107
  • Name: ethyl 4-(4-fluorophenyl)-6-oxo-2-phenyl-4,5-d ihydro-1H-pyrimidine-5-carboxylate
  • MW: 340.348 | Formula: C19H17FN2O3
  • H donors: 1 H acceptors: 2 LogP: 2.88 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOC(=O)C1C(=O)NC(=NC1c1ccc(cc1)F)c1ccccc1
  • InChi: 1S/C19H17FN2O3/c1-2-25-19(24)15-16(12-8-10-14(20)11-9-12)21-17(22-18(15)23)13-6-4-3-5-7-13/h3-11,15-16H,2H2,1H3,(H,21,22,23)
  • InChiKey: IAOZEBYUWKLMDE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-(4-fluorophenyl)-6-oxo-2-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
  • 4-(4-fluorophenyl)-6-keto-2-phenyl-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester
  • MLS000326146
  • SMR000170272
  • ethyl 4-(4-fluorophenyl)-6-hydroxy-2-phenyl-4,5-dihydro-5-pyrimidinecarboxylate
  • 1L-629S

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens polo-like kinase 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Entamoeba histolytica serine/threonine protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Brugia malayi serine/threonine-protein kinase plk-2 Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania braziliensis protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum ko:K06631 polo-like kinase 1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma mansoni serine/threonine protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus granulosus serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania infantum protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma congolense protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania mexicana protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Loa Loa (eye worm) PLK/PLK1 protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Schistosoma japonicum Serine/threonine-protein kinase PLK1, putative Get druggable targets OG5_127396 All targets in OG5_127396
Echinococcus multilocularis serine:threonine protein kinase PLK1 Get druggable targets OG5_127396 All targets in OG5_127396
Candida albicans protein serine/threonine kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma brucei gambiense polo-like protein kinase,protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Leishmania major protein kinase, putative,polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trichomonas vaginalis CAMK family protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma brucei polo-like protein kinase Get druggable targets OG5_127396 All targets in OG5_127396
Giardia lamblia Kinase, PLK Get druggable targets OG5_127396 All targets in OG5_127396
Trypanosoma cruzi polo-like protein kinase, putative Get druggable targets OG5_127396 All targets in OG5_127396
Onchocerca volvulus Serine\/threonine kinase homolog Get druggable targets OG5_127396 All targets in OG5_127396
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
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0029 0.021 0.021
Entamoeba histolytica hypothetical protein 0.0073 0.0772 0.5704
Echinococcus granulosus RNA directed DNA polymerase 0.0077 0.0824 0.2436
Schistosoma mansoni transcription factor LCR-F1 0.0073 0.0772 0.2212
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0055 0.0552 0.1581
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0048 0.0457 0.1887
Echinococcus granulosus PHD finger protein rhinoceros 0.0028 0.0202 0.0597
Schistosoma mansoni jumonji/arid domain-containing protein 0.0034 0.0278 0.0796
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0105 0.1189 1
Brugia malayi Matrix metalloprotease, N-terminal domain containing protein 0.0092 0.1026 0.4234
Schistosoma mansoni rab6-interacting 0.0019 0.0085 0.0242
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0114 0.131 1
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0114 0.131 0.3876
Echinococcus multilocularis jumonji domain containing protein 0.0039 0.0344 0.0344
Brugia malayi Animal haem peroxidase family protein 0.009 0.0998 0.4118
Brugia malayi Animal haem peroxidase family protein 0.009 0.0998 0.4118
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.021 0.0603
Echinococcus multilocularis matrix metallopeptidase 7 (M10 family) 0.0276 0.3381 0.3381
Schistosoma mansoni jumonji/arid domain-containing protein 0.0034 0.0278 0.0796
Brugia malayi Protein kinase domain containing protein 0.0017 0.0058 0.0239
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0017 0.0053 0.0152
Brugia malayi Animal haem peroxidase family protein 0.009 0.0998 0.4118
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0052 0.0504 0.208
Mycobacterium tuberculosis Probable peptidoglycan hydrolase 0.0092 0.1026 0.8563
Echinococcus multilocularis polycomb protein SCMH1 0.0046 0.0432 0.0432
Echinococcus granulosus SAM and MBT domain containing protein 0.0046 0.0432 0.1278
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.0202 0.9449
Schistosoma mansoni unc-13 (munc13) 0.0014 0.0022 0.0063
Schistosoma mansoni lipoxygenase 0.0019 0.0085 0.0242
Brugia malayi Protein kinase c protein 2 0.0091 0.1015 0.4188
Schistosoma mansoni peroxidasin 0.009 0.0998 0.2858
Entamoeba histolytica hypothetical protein 0.0073 0.0772 0.5704
Onchocerca volvulus Matrix metalloproteinase homolog 0.0168 0.2 0.717
Echinococcus granulosus unc 13 munc13 0.0014 0.0022 0.0065
Loa Loa (eye worm) hypothetical protein 0.0077 0.0824 0.3398
Plasmodium vivax multidomain scavenger receptor, putative 0.0019 0.0085 0.2001
Leishmania major hypothetical protein, conserved 0.0026 0.018 0.101
Brugia malayi mbt repeat family protein 0.0046 0.0432 0.1783
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.018 0.8074
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0028 0.0204 0.5
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0029 0.021 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0457 0.131
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0028 0.0204 0.5
Onchocerca volvulus Peroxidase homolog 0.009 0.0998 0.3538
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.131 1
Schistosoma mansoni hypothetical protein 0.0073 0.0772 0.2212
Loa Loa (eye worm) blistered cuticle protein 3 0.009 0.0998 0.4118
Entamoeba histolytica serine/threonine protein kinase, putative 0.0114 0.131 1
Loa Loa (eye worm) mbt repeat family protein 0.0046 0.0432 0.1783
Loa Loa (eye worm) phosphofructokinase 0.0105 0.1189 0.4907
Trichomonas vaginalis phosphofructokinase, putative 0.0028 0.0204 0.0571
Onchocerca volvulus 0.009 0.0998 0.3538
Echinococcus granulosus peregrin 0.0028 0.0202 0.0597
Plasmodium vivax hypothetical protein, conserved 0.0028 0.0202 0.9449
Echinococcus granulosus serine:threonine protein kinase N2 0.0017 0.0058 0.0171
Schistosoma mansoni polycystin 1-related 0.0019 0.0085 0.0242
Trichomonas vaginalis phosphofructokinase, putative 0.0105 0.1189 0.4176
Echinococcus granulosus NDR protein kinase 0.0017 0.0058 0.0171
Toxoplasma gondii phosphofructokinase PFKII 0.0028 0.0204 0.9617
Loa Loa (eye worm) hypothetical protein 0.0076 0.0814 0.3358
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0028 0.0204 0.9617
Echinococcus granulosus lysine specific demethylase 5A 0.0034 0.0278 0.0822
Schistosoma mansoni atypical protein kinase C 0.0029 0.0209 0.0598
Plasmodium falciparum phd finger protein, putative 0.0028 0.0202 0.9826
Onchocerca volvulus 0.0107 0.1221 0.4346
Schistosoma mansoni 6-phosphofructokinase 0.0105 0.1189 0.3406
Echinococcus multilocularis 6 phosphofructokinase 0.0105 0.1189 0.1189
Schistosoma mansoni hypothetical protein 0.028 0.344 0.9851
Schistosoma mansoni hypothetical protein 0.0178 0.2128 0.6093
Brugia malayi Hemopexin family protein 0.0107 0.1221 0.5037
Brugia malayi Hr1 repeat family protein 0.0017 0.0058 0.0239
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.021 0.0603
Entamoeba histolytica phosphofructokinase, putative 0.0105 0.1189 0.9034
Schistosoma mansoni serine/threonine protein kinase 0.0017 0.0058 0.0166
Onchocerca volvulus 0.0029 0.021 0.0683
Loa Loa (eye worm) AGC/DMPK/GEK protein kinase 0.0017 0.0058 0.0239
Brugia malayi Animal haem peroxidase family protein 0.009 0.0998 0.4118
Echinococcus granulosus 6 phosphofructokinase 0.0105 0.1189 0.3518
Plasmodium vivax 6-phosphofructokinase, putative 0.0028 0.0204 0.9617
Loa Loa (eye worm) hypothetical protein 0.0052 0.0514 0.2121
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0114 0.131 0.131
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0029 0.021 0.0603
Echinococcus multilocularis C2 calcium dependent membrane targeting 0.0014 0.0022 0.0022
Schistosoma mansoni hypothetical protein 0.0178 0.2128 0.6093
Echinococcus granulosus matrix metallopeptidase 7 M10 family 0.0276 0.3381 1
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.018 0.8074
Brugia malayi p70 ribosomal S6 kinase beta 0.0017 0.0058 0.0239
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Schistosoma mansoni matrix metallopeptidase-9 (M10 family) 0.008 0.0868 0.2486
Loa Loa (eye worm) 6-phosphofructokinase 0.0105 0.1189 0.4907
Mycobacterium ulcerans hydrolase 0.0092 0.1026 0.7439
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.0105 0.1189 0.9037
Brugia malayi Bromodomain containing protein 0.0028 0.0202 0.0833
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0017 0.0053 0.0157
Onchocerca volvulus Matrilysin homolog 0.0076 0.0814 0.287
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.131 0.4619
Echinococcus multilocularis protein kinase c epsilon type 0.0031 0.024 0.024
Brugia malayi hypothetical protein 0.009 0.0998 0.4118
Echinococcus granulosus Protein kinase C brain isozyme 0.0108 0.1224 0.3619
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0053 0.0053
Echinococcus multilocularis ribosomal protein S6 kinase alpha 3 0.0017 0.0058 0.0058
Loa Loa (eye worm) PHD-finger family protein 0.0028 0.0202 0.0833
Leishmania major ATP-dependent phosphofructokinase 0.0105 0.1189 0.9037
Brugia malayi hypothetical protein 0.0019 0.0085 0.0349
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0092 0.1025 0.3032
Mycobacterium ulcerans 6-phosphofructokinase 0.0105 0.1189 1
Echinococcus multilocularis peroxidasin 0.009 0.0998 0.0998
Trichomonas vaginalis phosphofructokinase, putative 0.0028 0.0204 0.0571
Brugia malayi Matrixin family protein 0.0076 0.0814 0.3358
Echinococcus multilocularis ribosomal protein s6 kinase beta 1 0.0017 0.0058 0.0058
Brugia malayi hypothetical protein 0.0017 0.006 0.0246
Brugia malayi jmjC domain containing protein 0.0092 0.1025 0.423
Echinococcus multilocularis serine:threonine protein kinase N2 0.0017 0.0058 0.0058
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0457 0.1353
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Toxoplasma gondii PHD-finger domain-containing protein 0.0028 0.0202 0.9449
Loa Loa (eye worm) transcription factor SMAD2 0.0125 0.1452 0.599
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0053 0.0053
Brugia malayi 6-phosphofructokinase 0.0105 0.1189 0.4907
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.0085 0.0085
Schistosoma mansoni protein kinase C 0.0014 0.0022 0.0063
Schistosoma mansoni serine/threonine kinase 0.0017 0.0058 0.0166
Entamoeba histolytica hypothetical protein 0.0073 0.0772 0.5704
Loa Loa (eye worm) AGC/PKC/ALPHA protein kinase 0.008 0.0864 0.3565
Brugia malayi MH2 domain containing protein 0.0125 0.1452 0.599
Echinococcus multilocularis serine:threonine protein kinase N2 0.0017 0.0058 0.0058
Echinococcus granulosus ribosomal protein S6 kinase alpha 3 0.0017 0.0058 0.0171
Echinococcus multilocularis telomerase reverse transcriptase subunit 0.0077 0.0824 0.0824
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Echinococcus granulosus RUN 0.0019 0.0085 0.025
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0028 0.0204 0.0571
Onchocerca volvulus Chorion peroxidase homolog 0.009 0.0998 0.3538
Loa Loa (eye worm) matrixin family protein 0.0168 0.2 0.8252
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0029 0.021 0.0603
Loa Loa (eye worm) hypothetical protein 0.0014 0.0022 0.0091
Plasmodium vivax 6-phosphofructokinase, putative 0.0028 0.0204 0.9617
Schistosoma mansoni hypothetical protein 0.01 0.1125 0.3222
Echinococcus granulosus ribosomal protein s6 kinase beta 1 0.0017 0.0058 0.0171
Schistosoma mansoni jumonji domain containing protein 0.0073 0.0782 0.2239
Trichomonas vaginalis phosphofructokinase, putative 0.0028 0.0204 0.0571
Loa Loa (eye worm) hypothetical protein 0.0017 0.0058 0.0239
Brugia malayi hypothetical protein 0.0026 0.018 0.0743
Brugia malayi Matrixin family protein 0.0076 0.0814 0.3358
Onchocerca volvulus 0.0076 0.0814 0.287
Trichomonas vaginalis set domain proteins, putative 0.0229 0.2781 1
Loa Loa (eye worm) AGC/RSK/RSK protein kinase 0.0017 0.0058 0.0239
Loa Loa (eye worm) DnaJ domain-containing protein 0.0059 0.06 0.2477
Brugia malayi Pre-SET motif family protein 0.0201 0.2424 1
Brugia malayi 6-phosphofructokinase 0.0105 0.1189 0.4907
Trichomonas vaginalis phosphofructokinase, putative 0.0105 0.1189 0.4176
Echinococcus multilocularis peregrin 0.0028 0.0202 0.0202
Brugia malayi Matrixin family protein 0.0076 0.0814 0.3358
Onchocerca volvulus 0.0019 0.0085 0.0227
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0028 0.0204 1
Echinococcus granulosus C2 calcium dependent membrane targeting 0.0014 0.0022 0.0065
Trichomonas vaginalis protein kinase inhibitor, putative 0.0059 0.06 0.202
Loa Loa (eye worm) AGC/RSK/P70 protein kinase 0.0017 0.0058 0.0239
Onchocerca volvulus 0.0019 0.0085 0.0227
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0017 0.0053 0.0053
Echinococcus granulosus polycomb protein SCMH1 0.0046 0.0432 0.1278
Schistosoma mansoni rab6-interacting 0.0019 0.0085 0.0242
Loa Loa (eye worm) hypothetical protein 0.0019 0.0085 0.0349
Schistosoma mansoni hypothetical protein 0.0028 0.0202 0.0578
Onchocerca volvulus Peroxidase homolog 0.009 0.0998 0.3538
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Loa Loa (eye worm) AGC/PKN protein kinase 0.0017 0.0058 0.0239
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.131 0.4619
Schistosoma mansoni sex comb on midleg homolog 0.0046 0.0432 0.1237
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.0105 0.1189 0.9037
Onchocerca volvulus 0.009 0.0998 0.3538
Echinococcus granulosus protein kinase c epsilon type 0.0031 0.024 0.071
Loa Loa (eye worm) hypothetical protein 0.0076 0.0814 0.3358
Schistosoma mansoni serine/threonine protein kinase 0.0017 0.0058 0.0166
Brugia malayi mbt repeat family protein 0.0046 0.0432 0.1783
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.018 0.101
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.131 0.4619
Brugia malayi Animal haem peroxidase family protein 0.009 0.0998 0.4118
Entamoeba histolytica phosphofructokinase, putative 0.0105 0.1189 0.9034
Loa Loa (eye worm) animal heme peroxidase 0.009 0.0998 0.4118
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0052 0.0514 0.2121
Echinococcus multilocularis unc 13 (munc13) 0.0014 0.0022 0.0022
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Schistosoma mansoni serine/threonine protein kinase 0.0017 0.0058 0.0166
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.018 0.8396
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.018 0.101
Trypanosoma brucei RNA helicase, putative 0.01 0.1125 0.8525
Brugia malayi PHD-finger family protein 0.0028 0.0202 0.0833
Onchocerca volvulus Serine\/threonine kinase homolog 0.0114 0.131 0.467
Entamoeba histolytica hypothetical protein 0.0073 0.0772 0.5704
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Echinococcus granulosus histone lysine methyltransferase setb 0.0029 0.021 0.0622
Schistosoma mansoni kinase 0.0058 0.0589 0.1688
Brugia malayi Protein kinase domain containing protein 0.0017 0.0058 0.0239
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Trypanosoma brucei polo-like protein kinase 0.0114 0.131 1
Schistosoma mansoni serine/threonine protein kinase 0.0108 0.1224 0.3504
Trichomonas vaginalis CAMK family protein kinase 0.0057 0.057 0.1909
Brugia malayi phosphofructokinase 0.0105 0.1189 0.4907
Echinococcus granulosus protein kinase c iota type 0.0029 0.0209 0.0617
Plasmodium vivax SET domain protein, putative 0.0029 0.021 1
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0182 0.2174 0.2174
Loa Loa (eye worm) AGC/AKT protein kinase 0.0017 0.0058 0.0239
Schistosoma mansoni serine/threonine protein kinase 0.0108 0.1224 0.3504
Schistosoma mansoni lipoxygenase 0.0053 0.0525 0.1504
Brugia malayi Protein kinase domain containing protein 0.0017 0.0058 0.0239
Brugia malayi Blistered cuticle protein 3 0.009 0.0998 0.4118
Trichomonas vaginalis phosphofructokinase, putative 0.0028 0.0204 0.0571
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Onchocerca volvulus Peroxidasin homolog 0.009 0.0998 0.3538
Onchocerca volvulus Matrilysin homolog 0.0168 0.2 0.717
Brugia malayi Peroxidasin 0.009 0.0998 0.4118
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0029 0.021 0.021
Loa Loa (eye worm) animal heme peroxidase 0.009 0.0998 0.4118
Schistosoma mansoni matrix metallopeptidase-7 (M10 family) 0.0076 0.0814 0.2331
Loa Loa (eye worm) hypothetical protein 0.0076 0.0814 0.3358
Onchocerca volvulus Peroxidasin homolog 0.009 0.0998 0.3538
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Schistosoma mansoni glucose-6-phosphatase 0.0284 0.3492 1
Loa Loa (eye worm) hypothetical protein 0.0046 0.0432 0.1783
Toxoplasma gondii 6-phosphofructokinase 0.0028 0.0204 0.9617
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0457 0.131
Echinococcus granulosus protein kinase C gamma type 0.0096 0.1073 0.3173
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0028 0.0197 0.0582
Loa Loa (eye worm) doublecortin family protein 0.0019 0.0085 0.0349
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Echinococcus multilocularis Ribosomal protein S6 kinase beta 2 0.0017 0.0058 0.0058
Echinococcus multilocularis isocitrate dehydrogenase 0.0017 0.0053 0.0053
Loa Loa (eye worm) jmjC domain-containing protein 0.0034 0.0278 0.1147
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.018 0.101
Echinococcus multilocularis Polycystic kidney disease protein 0.0019 0.0085 0.0085
Echinococcus granulosus Polycystic kidney disease protein 0.0019 0.0085 0.025
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0457 0.0457
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Schistosoma mansoni serine/threonine protein kinase 0.0114 0.131 0.3753
Brugia malayi Isocitrate dehydrogenase 0.0017 0.0053 0.0219
Schistosoma mansoni hypothetical protein 0.0107 0.1221 0.3496
Loa Loa (eye worm) animal heme peroxidase 0.009 0.0998 0.4118
Toxoplasma gondii AGC kinase 0.0017 0.0058 0.0299
Schistosoma mansoni peroxidasin 0.009 0.0998 0.2858
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.018 0.8396
Loa Loa (eye worm) jmjC domain-containing protein 0.0058 0.0587 0.2423
Trichomonas vaginalis phosphofructokinase, putative 0.0028 0.0204 0.0571
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.0105 0.1189 1
Brugia malayi hypothetical protein 0.0019 0.0085 0.0349
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.0085 0.025
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0028 0.0202 0.0578
Echinococcus multilocularis protein kinase c iota type 0.0029 0.0209 0.0209
Brugia malayi Matrixin family protein 0.0183 0.2195 0.9056
Schistosoma mansoni myelin transcription factor 1 myt1 0.0052 0.0514 0.1472
Loa Loa (eye worm) hypothetical protein 0.0029 0.021 0.0868
Trypanosoma brucei rac serine-threonine kinase, putative 0.0017 0.0058 0.0037
Echinococcus granulosus jumonji domain containing protein 0.0039 0.0344 0.1016
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0052 0.0514 0.152
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.0105 0.1189 1
Loa Loa (eye worm) isocitrate dehydrogenase 0.0017 0.0053 0.0219
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.131 0.4619
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0055 0.0552 0.2278
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0055 0.0552 0.0552
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.131 0.4619
Loa Loa (eye worm) animal heme peroxidase 0.009 0.0998 0.4118
Brugia malayi Doublecortin family protein 0.0019 0.0085 0.0349
Onchocerca volvulus Alhambra homolog 0.0028 0.0202 0.0652
Loa Loa (eye worm) 6-phosphofructokinase 0.0105 0.1189 0.4907
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Echinococcus multilocularis RNA directed DNA polymerase 0.0077 0.0824 0.0824
Trichomonas vaginalis phosphofructokinase, putative 0.0105 0.1189 0.4176
Echinococcus multilocularis conserved hypothetical protein 0.0282 0.3468 0.3468
Schistosoma mansoni sex comb on midleg homolog 0.0046 0.0432 0.1237
Schistosoma mansoni hypothetical protein 0.0019 0.0085 0.0242
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0201 0.2424 1
Echinococcus multilocularis RUN 0.0019 0.0085 0.0085
Schistosoma mansoni loxhd1 0.0019 0.0085 0.0242
Echinococcus multilocularis Protein kinase C, brain isozyme 0.0108 0.1224 0.1224
Loa Loa (eye worm) AGC/PKC/ETA protein kinase 0.0031 0.024 0.099
Echinococcus multilocularis histone acetyltransferase MYST2 0.0052 0.0514 0.0514
Brugia malayi Matrixin family protein 0.0076 0.0814 0.3358
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.131 0.4619
Echinococcus granulosus lipoxygenase domain containing protein 0.0019 0.0085 0.025
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0046 0.0432 0.1237
Schistosoma mansoni serine/threonine protein kinase 0.0031 0.024 0.0687
Loa Loa (eye worm) hypothetical protein 0.0088 0.0974 0.402
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0053 0.0053
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0053 0.0525 0.0525
Giardia lamblia Kinase, PLK 0.0114 0.131 1
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0028 0.0204 0.117
Brugia malayi jmjC domain containing protein 0.0034 0.0278 0.1147
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.0457 0.0457
Onchocerca volvulus Dual oxidase homolog 0.009 0.0998 0.3538
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Loa Loa (eye worm) AGC/RSK/MSK protein kinase 0.0017 0.0058 0.0239
Echinococcus multilocularis geminin 0.0178 0.2128 0.2128
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0055 0.0552 0.3968
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0055 0.0552 0.1633
Loa Loa (eye worm) AGC/NDR protein kinase 0.0017 0.0058 0.0239
Loa Loa (eye worm) hypothetical protein 0.0028 0.0202 0.0833
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0028 0.0204 0.0024
Brugia malayi hypothetical protein 0.0073 0.0772 0.3186
Schistosoma mansoni serine/threonine protein kinase 0.0017 0.0058 0.0166
Trichomonas vaginalis phosphofructokinase, putative 0.0105 0.1189 0.4176
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0053 0.0525 0.1553
Trichomonas vaginalis CAMK family protein kinase 0.0057 0.057 0.1909
Trichomonas vaginalis CAMK family protein kinase 0.0114 0.131 0.4619
Echinococcus multilocularis lysine specific demethylase 5A 0.0034 0.0278 0.0278
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0028 0.0204 1
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Brugia malayi serine/threonine-protein kinase plk-2 0.0114 0.131 0.5406
Onchocerca volvulus 0.009 0.0998 0.3538
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Schistosoma mansoni 6-phosphofructokinase 0.0105 0.1189 0.3406
Echinococcus multilocularis serine threonine protein kinase 0.0096 0.1073 0.1073
Echinococcus granulosus Ribosomal protein S6 kinase beta 2 0.0017 0.0058 0.0171
Loa Loa (eye worm) matrixin family protein 0.0183 0.2195 0.9056
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0114 0.131 0.5406
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0073 0.0772 0.2284
Plasmodium falciparum LCCL domain-containing protein 0.0019 0.0085 0.2081
Echinococcus granulosus dnaJ subfamily C 6 0.0059 0.06 0.1776
Trichomonas vaginalis phosphofructokinase, putative 0.0028 0.0204 0.0571
Loa Loa (eye worm) matrix metalloproteinase 0.0076 0.0814 0.3358
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.0457 0.1887
Trypanosoma cruzi polo-like protein kinase, putative 0.0114 0.131 1
Brugia malayi DnaJ domain containing protein 0.0059 0.06 0.2477
Echinococcus granulosus peroxidasin 0.009 0.0998 0.2952
Loa Loa (eye worm) MBCTL1 0.0052 0.0514 0.2121
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0073 0.0772 0.0772
Loa Loa (eye worm) hypothetical protein 0.0092 0.1026 0.4234
Onchocerca volvulus 0.0229 0.2781 1
Schistosoma mansoni hypothetical protein 0.0059 0.06 0.1719
Loa Loa (eye worm) hypothetical protein 0.0019 0.0085 0.0349
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.0457 0.1353
Brugia malayi Pre-SET motif family protein 0.0029 0.021 0.0868
Schistosoma mansoni unc-13 (munc13) 0.0016 0.0048 0.0137
Echinococcus multilocularis serine:threonine protein kinase 38 0.0017 0.0058 0.0058
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.0457 0.131
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Echinococcus multilocularis conserved hypothetical protein 0.0282 0.3468 0.3468
Echinococcus multilocularis SAM and MBT domain containing protein 0.0046 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0026 0.018 0.0743
Brugia malayi protein kinase C II. 0.0031 0.024 0.099
Echinococcus multilocularis dnaJ subfamily C 6 0.0059 0.06 0.06
Loa Loa (eye worm) hypothetical protein 0.0048 0.046 0.19
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0092 0.1025 0.1025
Entamoeba histolytica phosphofructokinase, putative 0.0105 0.1189 0.9034
Brugia malayi isocitrate dehydrogenase 0.0017 0.0053 0.0219
Trichomonas vaginalis AGC family protein kinase 0.0017 0.0058 0.0034
Loa Loa (eye worm) hypothetical protein 0.009 0.0998 0.4118
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0182 0.2174 0.6428
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0046 0.0432 0.1487
Echinococcus granulosus histone acetyltransferase MYST2 0.0052 0.0514 0.152
Echinococcus multilocularis lipoxygenase domain containing protein 0.0019 0.0085 0.0085
Echinococcus multilocularis PHD finger protein rhinoceros 0.0028 0.0202 0.0202
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0055 0.0552 0.4391
Echinococcus granulosus geminin 0.0178 0.2128 0.6293
Onchocerca volvulus 0.0046 0.0432 0.1487
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0052 0.0514 0.0514
Loa Loa (eye worm) MH2 domain-containing protein 0.0125 0.1452 0.599

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.4147 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 18.8876 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 39.8107 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] 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

Species name Source Reference Is orphan
Plasmodium falciparum 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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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