Detailed information for compound 1318204

Basic information

Technical information
  • TDR Targets ID: 1318204
  • Name: 2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4- b]indol-2-yl]sulfanyl]-N-(phenylmethyl)acetam ide
  • MW: 458.507 | Formula: C25H19FN4O2S
  • H donors: 2 H acceptors: 2 LogP: 4.78 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(CSc1nc2c(c(=O)n1c1ccc(cc1)F)[nH]c1c2cccc1)NCc1ccccc1
  • InChi: 1S/C25H19FN4O2S/c26-17-10-12-18(13-11-17)30-24(32)23-22(19-8-4-5-9-20(19)28-23)29-25(30)33-15-21(31)27-14-16-6-2-1-3-7-16/h1-13,28H,14-15H2,(H,27,31)
  • InChiKey: GETKKRNUKFYERQ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]thio]-N-(phenylmethyl)acetamide
  • N-(benzyl)-2-[[3-(4-fluorophenyl)-4-keto-5H-pyrimido[5,4-b]indol-2-yl]thio]acetamide
  • 2-[[3-(4-fluorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(phenylmethyl)ethanamide
  • G856-1162
  • NCGC00135429-01
  • EU-0055808
  • Oprea1_062997

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

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

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0041 0.0053
Echinococcus multilocularis polycomb protein SCMH1 0.0054 0.1378 0.1949
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.0041 0.0041
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.0041 0.0041
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.004 0.094 0.0695
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.004 0.094 0.1328
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0221 0.6473 0.9173
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.004 0.094 0.0695
Trypanosoma brucei ATP-dependent 6-phosphofructokinase, glycosomal 0.024 0.7057 1
Trichomonas vaginalis phosphofructokinase, putative 0.0065 0.1709 0.0932
Brugia malayi Nuclear hormone receptor family member nhr-40 0.001 0.0041 0.0045
Trypanosoma brucei unspecified product 0.0055 0.1406 0.1403
Brugia malayi Tyrosyl-DNA phosphodiesterase family protein 0.0075 0.2012 0.2191
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0041 0.0053
Trypanosoma brucei DNA polymerase IV, putative 0.011 0.3079 0.3949
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0016 0.0207 0.0288
Echinococcus granulosus dna polymerase kappa 0.011 0.3079 0.4361
Loa Loa (eye worm) hypothetical protein 0.001 0.0041 0.0041
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.0041 0.0041
Echinococcus multilocularis SAM and MBT domain containing protein 0.0054 0.1378 0.1949
Trichomonas vaginalis phosphofructokinase, putative 0.024 0.7057 0.7422
Mycobacterium ulcerans DNA polymerase IV 0.011 0.3079 0.2985
Trichomonas vaginalis phosphofructokinase, putative 0.0065 0.1709 0.0932
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0041 0.0053
Onchocerca volvulus 0.0054 0.1378 0.3188
Trypanosoma brucei DNA polymerase IV, putative 0.0102 0.2851 0.3602
Brugia malayi mbt repeat family protein 0.0054 0.1378 0.1501
Toxoplasma gondii exonuclease III APE 0.004 0.094 0.3728
Trichomonas vaginalis phosphofructokinase, putative 0.024 0.7057 0.7422
Trichomonas vaginalis DNA polymerase eta, putative 0.011 0.3079 0.2596
Trichomonas vaginalis glutaminase, putative 0.031 0.9181 1
Mycobacterium ulcerans 6-phosphofructokinase 0.024 0.7057 0.7557
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0761 0.0829
Echinococcus multilocularis GPCR, family 2 0.0016 0.0207 0.0288
Brugia malayi Nuclear hormone receptor family member nhr-3 0.001 0.0041 0.0045
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.006 0.1574 0.2227
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0062 0.1607 0.2273
Brugia malayi Steroid receptor seven-up type 2 0.001 0.0041 0.0045
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.004 0.094 0.3728
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.006 0.1574 0.1037
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1685 0.1651
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0041 0.0053
Loa Loa (eye worm) hypothetical protein 0.0062 0.1607 0.1747
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.161 0.1575
Schistosoma mansoni cpg binding protein 0.0031 0.0666 0.0628
Echinococcus multilocularis dna polymerase eta 0.0108 0.3041 0.4306
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0075 0.2012 0.2325
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0087 0.2388 0.2367
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0041 0.0045
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.0065 0.1709 0.1256
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0041 0.0053
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Brugia malayi TAR-binding protein 0.0064 0.1685 0.1835
Toxoplasma gondii phosphofructokinase domain-containing protein 0.0065 0.1709 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1685 0.1651
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0041 0.0053
Onchocerca volvulus 0.0148 0.4236 1
Schistosoma mansoni hypothetical protein 0.0016 0.0207 0.0166
Brugia malayi hypothetical protein 0.0148 0.4236 0.4614
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.1106 0.1205
Schistosoma mansoni sex comb on midleg homolog 0.0054 0.1378 0.1343
Loa Loa (eye worm) hypothetical protein 0.001 0.0041 0.0041
Leishmania major DNA polymerase eta, putative 0.0108 0.3041 0.3891
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Toxoplasma gondii aldehyde dehydrogenase 0.006 0.1574 0.8903
Schistosoma mansoni hypothetical protein 0.0034 0.0761 0.0723
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.004 0.094 0.5
Brugia malayi Nuclear hormone receptor family member nhr-49 0.001 0.0041 0.0045
Loa Loa (eye worm) 6-phosphofructokinase 0.024 0.7057 0.7685
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.008 0.216 0.3058
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Echinococcus granulosus GPCR family 2 0.0016 0.0207 0.0288
Brugia malayi glutaminase DH11.1 0.031 0.9181 1
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0032 0.0712 0.1862
Echinococcus granulosus tyrosyl DNA phosphodiesterase 1 0.0075 0.2012 0.2847
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1685 0.1651
Schistosoma mansoni 6-phosphofructokinase 0.024 0.7057 0.7044
Trichomonas vaginalis phosphofructokinase, putative 0.0065 0.1709 0.0932
Trypanosoma brucei DNA polymerase kappa, putative 0.0062 0.1634 0.175
Brugia malayi 6-phosphofructokinase 0.024 0.7057 0.7686
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.004 0.094 0.2398
Loa Loa (eye worm) hypothetical protein 0.0148 0.4236 0.4612
Trypanosoma brucei unspecified product 0.0102 0.2851 0.3602
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0041 0.0045
Mycobacterium tuberculosis Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase) 0.024 0.7057 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0016 0.0207 0.0225
Brugia malayi photoreceptor-specific nuclear receptor 0.001 0.0041 0.0045
Brugia malayi Nuclear hormone receptor family member nhr-14 0.001 0.0041 0.0045
Trypanosoma brucei DNA polymerase kappa, putative 0.0055 0.1403 0.1399
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0616 0.0667
Echinococcus multilocularis 6 phosphofructokinase 0.024 0.7057 1
Leishmania major tyrosyl-DNA phosphodiesterase 1 0.0075 0.2012 0.2325
Toxoplasma gondii histone lysine methyltransferase SET1 0.0055 0.1409 0.7554
Brugia malayi polk-prov protein 0.0055 0.1403 0.1528
Loa Loa (eye worm) hypothetical protein 0.0034 0.0761 0.0826
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1106 0.1069
Brugia malayi Nuclear hormone receptor family member nhr-41 0.001 0.0041 0.0045
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.004 0.094 0.0525
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.1574 0.154
Entamoeba histolytica deoxycytidyl transferase, putative 0.008 0.216 0.1994
Trichomonas vaginalis 6-phosphofructokinase, putative 0.0065 0.1709 0.0932
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0016 0.0207 0.0288
Loa Loa (eye worm) hypothetical protein 0.0108 0.3041 0.3309
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0041 0.0053
Schistosoma mansoni hypothetical protein 0.0016 0.0207 0.0166
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0041 0.0045
Brugia malayi Nuclear hormone receptor family member nhr-19 0.001 0.0041 0.0045
Mycobacterium ulcerans DNA polymerase IV 0.011 0.3079 0.2985
Trichomonas vaginalis phosphofructokinase, putative 0.024 0.7057 0.7422
Trypanosoma brucei DNA polymerase kappa, putative 0.0062 0.1634 0.175
Schistosoma mansoni terminal deoxycytidyl transferase 0.008 0.216 0.2128
Echinococcus multilocularis dna polymerase kappa 0.011 0.3079 0.4361
Loa Loa (eye worm) hypothetical protein 0.0049 0.1239 0.1346
Trypanosoma cruzi DNA polymerase kappa, putative 0.011 0.3079 0.3949
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1685 0.1651
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0065 0.1709 1
Schistosoma mansoni cpg binding protein 0.0029 0.0616 0.0577
Schistosoma mansoni aldehyde dehydrogenase 0.006 0.1574 0.154
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0065 0.1709 0.5
Loa Loa (eye worm) latrophilin receptor protein 2 0.0016 0.0207 0.0222
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.1685 0.1835
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0041 0.0053
Loa Loa (eye worm) hypothetical protein 0.001 0.0041 0.0041
Loa Loa (eye worm) tyrosyl-DNA phosphodiesterase 0.0075 0.2012 0.2188
Echinococcus multilocularis tyrosyl DNA phosphodiesterase 1 0.0075 0.2012 0.2847
Toxoplasma gondii phosphofructokinase PFKII 0.0065 0.1709 1
Entamoeba histolytica pyrophosphate-dependent phosphofructokinase 0.0065 0.1709 0.1256
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.0054 0.1378 0.1498
Trypanosoma brucei unspecified product 0.0055 0.1406 0.1403
Echinococcus granulosus SAM and MBT domain containing protein 0.0054 0.1378 0.1949
Schistosoma mansoni hypothetical protein 0.0016 0.0207 0.0166
Loa Loa (eye worm) phosphofructokinase 0.024 0.7057 0.7685
Giardia lamblia DINP protein human, muc B family 0.0087 0.2388 1
Schistosoma mansoni ap endonuclease 0.004 0.094 0.0903
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0054 0.1378 0.1343
Trichomonas vaginalis phosphofructokinase, putative 0.024 0.7057 0.7422
Treponema pallidum diphosphate--fructose-6-phosphate 1-phosphotransferase 0.024 0.7057 1
Trypanosoma cruzi ATP-dependent 6-phosphofructokinase, glycosomal 0.024 0.7057 1
Schistosoma mansoni ap endonuclease 0.004 0.094 0.0903
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.004 0.094 0.1021
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.1574 0.1254
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0087 0.2388 0.2898
Loa Loa (eye worm) hypothetical protein 0.0016 0.0207 0.0222
Loa Loa (eye worm) glutaminase 0.031 0.9181 1
Brugia malayi exodeoxyribonuclease III family protein 0.004 0.094 0.1024
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.004 0.094 0.1328
Schistosoma mansoni sex comb on midleg homolog 0.0054 0.1378 0.1343
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.1106 0.1563
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.1106 0.1563
Trichomonas vaginalis phosphofructokinase, putative 0.0065 0.1709 0.0932
Brugia malayi mbt repeat family protein 0.0054 0.1378 0.1501
Echinococcus granulosus dna polymerase eta 0.0108 0.3041 0.4306
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.1106 0.1563
Echinococcus multilocularis histone acetyltransferase MYST2 0.0062 0.1607 0.2273
Loa Loa (eye worm) glutaminase 2 0.031 0.9181 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.1239 0.135
Echinococcus multilocularis geminin 0.0167 0.483 0.6843
Schistosoma mansoni tar DNA-binding protein 0.0064 0.1685 0.1651
Schistosoma mansoni hypothetical protein 0.0167 0.483 0.4809
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0041 0.0053
Plasmodium vivax 6-phosphofructokinase, putative 0.0065 0.1709 1
Schistosoma mansoni hypothetical protein 0.0016 0.0207 0.0166
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.008 0.216 0.2128
Brugia malayi ecdysteroid receptor 0.001 0.0041 0.0045
Schistosoma mansoni myelin transcription factor 1 myt1 0.0062 0.1607 0.1572
Brugia malayi nuclear receptor NHR-88 0.001 0.0041 0.0045
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.008 0.216 0.3058
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.008 0.216 0.235
Trypanosoma brucei DNA polymerase eta, putative 0.0108 0.3041 0.3891
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.001 0.0041 0.0045
Entamoeba histolytica phosphofructokinase, putative 0.024 0.7057 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.1685 0.1832
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0062 0.1607 0.2273
Toxoplasma gondii 6-phosphofructokinase 0.0065 0.1709 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.001 0.0041 0.0045
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0054 0.1364 0.719
Loa Loa (eye worm) MBCTL1 0.0062 0.1607 0.1747
Trypanosoma cruzi DNA polymerase eta, putative 0.0108 0.3041 0.3891
Leishmania major DNA polymerase kappa, putative 0.0087 0.2388 0.2898
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0041 0.0045
Brugia malayi Latrophilin receptor protein 2 0.0016 0.0207 0.0225
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.1106 0.1563
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.0041 0.0041
Echinococcus granulosus transcription factor Dp 1 0.0043 0.105 0.1484
Echinococcus granulosus 6 phosphofructokinase 0.024 0.7057 1
Loa Loa (eye worm) TAR-binding protein 0.0064 0.1685 0.1832
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.1239 0.135
Schistosoma mansoni hypothetical protein 0.0167 0.483 0.4809
Echinococcus multilocularis transcription factor Dp 1 0.0043 0.105 0.1484
Plasmodium falciparum ATP-dependent 6-phosphofructokinase 0.0065 0.1709 1
Echinococcus granulosus histone acetyltransferase MYST2 0.0062 0.1607 0.2273
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.006 0.1574 0.1659
Echinococcus granulosus FTZ F1 alpha 0.001 0.0041 0.0053
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0041 0.0053
Schistosoma mansoni glutaminase 0.031 0.9181 0.9178
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.004 0.094 0.0695
Echinococcus granulosus tar DNA binding protein 0.0064 0.1685 0.2384
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0041 0.0053
Loa Loa (eye worm) 6-phosphofructokinase 0.024 0.7057 0.7685
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0041 0.0053
Plasmodium vivax 6-phosphofructokinase, putative 0.0065 0.1709 1
Loa Loa (eye worm) RNA binding protein 0.0064 0.1685 0.1832
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0062 0.1607 0.175
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0221 0.6473 0.9173
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.004 0.094 0.3728
Entamoeba histolytica phosphofructokinase, putative 0.024 0.7057 1
Brugia malayi CXXC zinc finger family protein 0.0029 0.0616 0.0671
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0041 0.0053
Brugia malayi nuclear hormone receptor 0.001 0.0041 0.0045
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.006 0.1574 0.2227
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0041 0.0053
Chlamydia trachomatis fructose-6-phosphate phosphotransferase 0.0065 0.1709 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1106 0.1069
Brugia malayi phosphofructokinase 0.024 0.7057 0.7686
Trypanosoma brucei DNA polymerase kappa, putative 0.0062 0.1634 0.175
Trypanosoma cruzi DNA polymerase eta, putative 0.0054 0.1364 0.134
Echinococcus granulosus cpg binding protein 0.0031 0.0666 0.094
Brugia malayi Nuclear hormone receptor family member nhr-31 0.001 0.0041 0.0045
Entamoeba histolytica tyrosyl-DNA phosphodiesterase, putative 0.0075 0.2012 0.1752
Loa Loa (eye worm) hypothetical protein 0.001 0.0041 0.0041
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Mycobacterium leprae PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE) 0.024 0.7057 0.5
Leishmania major ATP-dependent phosphofructokinase 0.024 0.7057 1
Echinococcus multilocularis cpg binding protein 0.0031 0.0666 0.094
Trypanosoma brucei DNA polymerase kappa, putative 0.0055 0.1403 0.1399
Trypanosoma cruzi DNA polymerase kappa, putative 0.011 0.3079 0.3949
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0054 0.1378 0.3188
Brugia malayi ImpB/MucB/SamB family protein 0.008 0.216 0.2353
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0041 0.0053
Echinococcus granulosus polycomb protein SCMH1 0.0054 0.1378 0.1949
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Onchocerca volvulus 0.0029 0.0616 0.137
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.1106 0.1069
Brugia malayi 6-phosphofructokinase 0.024 0.7057 0.7686
Trypanosoma brucei DNA polymerase kappa, putative 0.0087 0.2388 0.2898
Leishmania major DNA polymerase eta, putative 0.0054 0.1364 0.134
Brugia malayi Nuclear hormone receptor family member nhr-25 0.001 0.0041 0.0045
Schistosoma mansoni 6-phosphofructokinase 0.024 0.7057 0.7044
Trypanosoma cruzi DNA polymerase kappa, putative 0.011 0.3079 0.3949
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0016 0.0207 0.0288
Echinococcus multilocularis tar DNA binding protein 0.0064 0.1685 0.2384
Trypanosoma cruzi DNA polymerase kappa, putative 0.011 0.3079 0.3949
Loa Loa (eye worm) steroid hormone receptor 0.001 0.0041 0.0041
Schistosoma mansoni cpg binding protein 0.0031 0.0666 0.0628
Entamoeba histolytica phosphofructokinase, putative 0.024 0.7057 1
Brugia malayi RNA binding protein 0.0064 0.1685 0.1835
Loa Loa (eye worm) hypothetical protein 0.001 0.0041 0.0041
Trypanosoma brucei DNA polymerase IV, putative 0.011 0.3079 0.3949
Loa Loa (eye worm) hypothetical protein 0.001 0.0041 0.0041
Trypanosoma cruzi tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0075 0.2012 0.2325
Loa Loa (eye worm) hypothetical protein 0.001 0.0041 0.0041
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.0041 0.0041
Giardia lamblia Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit 0.0065 0.1709 0.6433
Schistosoma mansoni DNA polymerase eta 0.0108 0.3041 0.3012
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.011 0.3079 0.2596
Mycobacterium ulcerans glutaminase 0.031 0.9181 1
Schistosoma mansoni DNA polymerase IV / kappa 0.0025 0.0484 0.0444
Trypanosoma brucei tyrosyl-DNA Phosphodiesterase (Tdp1), putative 0.0075 0.2012 0.2325
Brugia malayi steroid hormone receptor 0.001 0.0041 0.0045
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.1574 0.1254
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0041 0.0053
Trypanosoma brucei DNA polymerase kappa, putative 0.011 0.3079 0.3949
Trichomonas vaginalis phosphofructokinase, putative 0.0065 0.1709 0.0932
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0016 0.0207 0.0288
Echinococcus granulosus geminin 0.0167 0.483 0.6843
Loa Loa (eye worm) hypothetical protein 0.0055 0.1403 0.1525
Trichomonas vaginalis phosphofructokinase, putative 0.0065 0.1709 0.0932
Schistosoma mansoni tyrosyl-DNA phosphodiesterase 0.0075 0.2012 0.1979
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0041 0.0053
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.004 0.094 0.0695
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.1106 0.1201
Mycobacterium ulcerans aldehyde dehydrogenase 0.006 0.1574 0.1254
Mycobacterium tuberculosis Conserved hypothetical protein 0.008 0.216 0.1994
Loa Loa (eye worm) mbt repeat family protein 0.0054 0.1378 0.1498
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.0041 0.0041
Loa Loa (eye worm) hypothetical protein 0.001 0.0041 0.0041
Brugia malayi ImpB/MucB/SamB family protein 0.0108 0.3041 0.3312
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.1239 0.1346

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 31.6228 um PUBCHEM_BIOASSAY: qHTS Screen for Compounds that Selectively Target Cancer Cells with p53 Mutations: Cytotoxicity of p53ts Cells at the Nonpermissive Temperature. (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

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.

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