Detailed information for compound 872047

Basic information

Technical information
  • TDR Targets ID: 872047
  • Name: N-(2,5-dichlorophenyl)-5-furan-2-yl-1,2-oxazo le-3-carboxamide
  • MW: 323.131 | Formula: C14H8Cl2N2O3
  • H donors: 1 H acceptors: 2 LogP: 3.56 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(c(c1)NC(=O)c1noc(c1)c1ccco1)Cl
  • InChi: 1S/C14H8Cl2N2O3/c15-8-3-4-9(16)10(6-8)17-14(19)11-7-13(21-18-11)12-2-1-5-20-12/h1-7H,(H,17,19)
  • InChiKey: WAKDFUVTMCWFBT-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(2,5-dichlorophenyl)-5-(2-furyl)isoxazole-3-carboxamide
  • N-(2,5-dichlorophenyl)-5-(2-furyl)-3-isoxazolecarboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens ATPase family, AAA domain containing 5 Starlite/ChEMBL No references
Homo sapiens nuclear factor, erythroid 2-like 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core Get druggable targets OG5_139225 All targets in OG5_139225
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
Chlamydia trachomatis DNA gyrase subunit B 0.0083 0.0482 1
Schistosoma mansoni aldehyde dehydrogenase 0.0058 0.0308 0.0308
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.004 0.0142
Echinococcus multilocularis pyruvate kinase 0.0036 0.0152 0.0152
Giardia lamblia Pyruvate kinase 0.0036 0.0152 0.0457
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0021 0.004 0.004
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0043 0.0202 0.0202
Trichomonas vaginalis CAMK family protein kinase 0.0103 0.0628 0.1803
Plasmodium vivax heat shock protein 90, putative 0.0166 0.108 0.3868
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0021 0.004 0.004
Echinococcus granulosus survival motor neuron protein 1 0.0227 0.1513 0.1513
Trichomonas vaginalis sensor histidine kinase, putative 0.0083 0.0482 0.1253
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0021 0.004 0.0142
Trichomonas vaginalis CAMK family protein kinase 0.0103 0.0628 0.1803
Brugia malayi ecdysteroid receptor 0.0021 0.004 0.0142
Loa Loa (eye worm) pyruvate kinase 0.0036 0.0152 0.0543
Loa Loa (eye worm) hypothetical protein 0.0083 0.0482 0.1728
Entamoeba histolytica DNA topoisomerase II, putative 0.0083 0.0482 0.1506
Loa Loa (eye worm) hypothetical protein 0.0048 0.0234 0.0836
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0021 0.004 0.0142
Schistosoma mansoni survival motor neuron protein 0.0046 0.0222 0.0222
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.004 0.0142
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0021 0.004 0.004
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Plasmodium vivax DNA topoisomerase II, putative 0.0083 0.0482 0.1728
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0083 0.0482 0.1728
Leishmania major pyruvate kinase 0.0036 0.0152 0.0543
Entamoeba histolytica hypothetical protein 0.0043 0.0202 0.0475
Trypanosoma brucei heat shock protein, putative 0.0406 0.2792 1
Trypanosoma cruzi DNA topoisomerase II, putative 0.0083 0.0482 0.1728
Loa Loa (eye worm) endoplasmin 0.0406 0.2792 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0021 0.004 0.0142
Brugia malayi steroid hormone receptor 0.0021 0.004 0.0142
Mycobacterium ulcerans aldehyde dehydrogenase 0.0058 0.0308 0.0379
Toxoplasma gondii Hsp90 domain-containing protein 0.0166 0.108 0.3868
Echinococcus multilocularis heat shock protein 90 0.0406 0.2792 0.2792
Echinococcus granulosus pyruvate kinase 0.0036 0.0152 0.0152
Loa Loa (eye worm) hypothetical protein 0.0021 0.004 0.0142
Mycobacterium tuberculosis Probable two component sensor kinase 0.0083 0.0482 0.1127
Giardia lamblia Pms1-like protein 0.0083 0.0482 0.1653
Mycobacterium ulcerans two component system membrane associated sensor kinase 0.0083 0.0482 0.0801
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.004 0.0142
Mycobacterium ulcerans two component sensor histidine kinase SenX3 0.0083 0.0482 0.0801
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0021 0.004 0.004
Plasmodium vivax endoplasmin, putative 0.0406 0.2792 1
Echinococcus multilocularis pyruvate kinase 0.0019 0.0025 0.0025
Brugia malayi Pyruvate kinase, muscle isozyme 0.0036 0.0152 0.0543
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0323 0.2201 0.2201
Mycobacterium tuberculosis Possible two component system response sensor kinase membrane associated PhoR 0.0083 0.0482 0.1127
Schistosoma mansoni retinoic acid receptor RXR 0.0021 0.004 0.004
Trichomonas vaginalis CAMK family protein kinase 0.0103 0.0628 0.1803
Giardia lamblia Heat shock protein HSP 90-alpha 0.0406 0.2792 1
Schistosoma mansoni thyroid hormone receptor 0.0021 0.004 0.004
Plasmodium vivax hypothetical protein, conserved 0.0083 0.0482 0.1728
Loa Loa (eye worm) hypothetical protein 0.0036 0.0152 0.0543
Entamoeba histolytica heat shock protein 90, putative 0.0406 0.2792 1
Schistosoma mansoni pyruvate kinase 0.0019 0.0025 0.0025
Loa Loa (eye worm) hypothetical protein 0.0083 0.0482 0.1728
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0021 0.004 0.0142
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0083 0.0482 0.1127
Plasmodium falciparum pyruvate kinase 2 0.0019 0.0025 0.009
Mycobacterium tuberculosis Two component sensor histidine kinase PrrB 0.0083 0.0482 0.1127
Entamoeba histolytica hypothetical protein 0.0043 0.0202 0.0475
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Echinococcus multilocularis geminin 0.0163 0.1054 0.1054
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0103 0.0628 0.2248
Brugia malayi HSF-type DNA-binding domain containing protein 0.0095 0.0572 0.2047
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0036 0.0152 0.0354
Mycobacterium leprae Probable two component sensor kinase MprB 0.0083 0.0482 0.1614
Plasmodium vivax pyruvate kinase 2, putative 0.0019 0.0025 0.009
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Mycobacterium tuberculosis Two component sensory transduction histidine kinase MtrB 0.0083 0.0482 0.1127
Entamoeba histolytica serine/threonine protein kinase, putative 0.0103 0.0628 0.204
Schistosoma mansoni RAR-like nuclear receptor 0.0021 0.004 0.004
Mycobacterium ulcerans two component sensor histidine kinase TrcS 0.0083 0.0482 0.0801
Trichomonas vaginalis sensory transduction histidine kinase bacterial, putative 0.0083 0.0482 0.1253
Onchocerca volvulus Heat shock factor protein 2 homolog 0.0095 0.0572 0.5112
Leishmania major pyruvate kinase 0.0036 0.0152 0.0543
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0083 0.0482 0.4255
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0021 0.004 0.004
Brugia malayi serine/threonine-protein kinase plk-2 0.0103 0.0628 0.2248
Mycobacterium tuberculosis Two component sensor kinase MprB 0.0083 0.0482 0.1127
Echinococcus multilocularis ecdysone induced protein 78C 0.0021 0.004 0.004
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Plasmodium vivax DNA gyrase subunit B, putative 0.0083 0.0482 0.1728
Mycobacterium ulcerans arylamine N-acetyltransferase Nat 0.0614 0.428 1
Plasmodium falciparum heat shock protein 90, putative 0.0166 0.108 0.3868
Plasmodium vivax heat shock protein 86, putative 0.0406 0.2792 1
Leishmania major developmentally regulated phosphoprotein-like protein 0.0083 0.0482 0.1728
Echinococcus multilocularis FTZ F1 alpha 0.0021 0.004 0.004
Mycobacterium tuberculosis Possible two component sensor kinase TcrY 0.0083 0.0482 0.1127
Loa Loa (eye worm) hypothetical protein 0.0033 0.0125 0.0449
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Echinococcus multilocularis microtubule associated protein 2 0.1415 1 1
Trypanosoma cruzi heat shock protein 85, putative 0.0406 0.2792 1
Echinococcus multilocularis survival motor neuron protein 1 0.0227 0.1513 0.1513
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0083 0.0482 0.1127
Plasmodium falciparum DNA topoisomerase VI, b subunit, putative 0.0083 0.0482 0.1728
Trypanosoma brucei pyruvate kinase 1 0.0036 0.0152 0.0543
Schistosoma mansoni coup transcription factor 0.0021 0.004 0.004
Loa Loa (eye worm) hypothetical protein 0.0083 0.0482 0.1728
Mycobacterium ulcerans aldehyde dehydrogenase 0.0058 0.0308 0.0379
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0021 0.004 0.0142
Leishmania major heat shock protein, putative 0.0166 0.108 0.3868
Brugia malayi heat shock protein 90 0.0406 0.2792 1
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0083 0.0482 0.0801
Echinococcus multilocularis heat shock protein 0.0406 0.2792 0.2792
Trichomonas vaginalis sensory transduction histidine kinase, putative 0.0083 0.0482 0.1253
Echinococcus multilocularis atpase aaa+ type core atpase aaa type core 0.0979 0.6889 0.6889
Schistosoma mansoni pyruvate dehydrogenase 0.0083 0.0482 0.0482
Mycobacterium ulcerans two component sensory transduction histidine kinase MtrB 0.0083 0.0482 0.0801
Trypanosoma cruzi DNA topoisomerase II, putative 0.0083 0.0482 0.1728
Trypanosoma brucei heat shock protein, putative 0.0406 0.2792 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.004 0.0142
Schistosoma mansoni kinase 0.0052 0.0266 0.0266
Trichomonas vaginalis endoplasmin, putative 0.0249 0.1671 0.5754
Echinococcus granulosus endoplasmin 0.0323 0.2201 0.2201
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0323 0.2201 1
Loa Loa (eye worm) steroid hormone receptor 0.0021 0.004 0.0142
Trypanosoma brucei heat shock protein 90, putative 0.0406 0.2792 1
Toxoplasma gondii heat shock protein 90, putative 0.0406 0.2792 1
Trypanosoma cruzi heat shock protein 90, putative 0.0406 0.2792 1
Leishmania major hypothetical protein, conserved 0.0083 0.0482 0.1728
Mycobacterium tuberculosis Conserved protein 0.0083 0.0482 0.1127
Trichomonas vaginalis CAMK family protein kinase 0.0103 0.0628 0.1803
Loa Loa (eye worm) hypothetical protein 0.0227 0.1513 0.542
Schistosoma mansoni heat shock protein 0.0406 0.2792 0.2792
Trypanosoma cruzi developmentally regulated phosphoprotein, putative 0.0083 0.0482 0.1728
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0083 0.0482 0.4255
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0021 0.004 0.0142
Toxoplasma gondii pyruvate kinase PyKII 0.0019 0.0025 0.009
Toxoplasma gondii DNA topoisomerase 2, putative 0.0083 0.0482 0.1728
Trypanosoma cruzi pyruvate kinase 2, putative 0.0036 0.0152 0.0543
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0021 0.004 0.0142
Echinococcus multilocularis pyruvate kinase 0.0036 0.0152 0.0152
Entamoeba histolytica heat shock transcription factor, putative 0.0095 0.0572 0.1834
Schistosoma mansoni endoplasmin 0.0406 0.2792 0.2792
Schistosoma mansoni microtubule-associated protein tau 0.1415 1 1
Mycobacterium ulcerans putative regultory protein 0.0083 0.0482 0.0801
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0083 0.0482 0.0482
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0021 0.004 0.004
Toxoplasma gondii pyruvate kinase PyK1 0.0036 0.0152 0.0543
Schistosoma mansoni pyruvate kinase 0.0036 0.0152 0.0152
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0083 0.0482 0.1728
Mycobacterium tuberculosis Probable sensor protein KdpD 0.0083 0.0482 0.1127
Schistosoma mansoni thyroid hormone receptor 0.0021 0.004 0.004
Mycobacterium tuberculosis Arylamine N-acetyltransferase Nat (arylamine acetylase) 0.0614 0.428 1
Giardia lamblia Grp94/Hsp90 0.0323 0.2201 0.7865
Giardia lamblia Heat shock protein HSP 90-alpha 0.0323 0.2201 0.7865
Echinococcus granulosus pyruvate kinase 0.0019 0.0025 0.0025
Plasmodium falciparum DNA gyrase subunit B 0.0083 0.0482 0.1728
Entamoeba histolytica hypothetical protein 0.0043 0.0202 0.0475
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0083 0.0482 0.0482
Trypanosoma brucei developmentally regulated phosphoprotein 0.0083 0.0482 0.1728
Mycobacterium leprae PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3 0.0083 0.0482 0.1614
Trypanosoma brucei heat shock protein, putative 0.0406 0.2792 1
Echinococcus multilocularis pyruvate kinase 0.0029 0.0097 0.0097
Loa Loa (eye worm) TOPoisomerase family member 0.0083 0.0482 0.1728
Trichomonas vaginalis DNA topoisomerase II, putative 0.0083 0.0482 0.1253
Plasmodium falciparum pyruvate kinase 0.0036 0.0152 0.0543
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.004 0.004
Brugia malayi nuclear hormone receptor 0.0021 0.004 0.0142
Plasmodium vivax heat shock protein, putative 0.0166 0.108 0.3868
Onchocerca volvulus Pyruvate kinase homolog 0.0036 0.0152 0.1075
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0323 0.2201 0.7884
Trypanosoma brucei heat shock protein, putative 0.0406 0.2792 1
Echinococcus granulosus heat shock protein 90 0.0406 0.2792 0.2792
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Trichomonas vaginalis heat shock protein, putative 0.0323 0.2201 0.7763
Trichomonas vaginalis two component sensor and regulator histidine kinase bacteria, putative 0.0083 0.0482 0.1253
Echinococcus multilocularis pyruvate kinase 0.0019 0.0025 0.0025
Brugia malayi Endoplasmin precursor 0.0406 0.2792 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0021 0.004 0.004
Entamoeba histolytica 90 kDa heat shock protein, putative 0.0166 0.108 0.3704
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) 0.0323 0.2201 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.0234 0.0836
Trypanosoma cruzi pyruvate kinase 2, putative 0.0036 0.0152 0.0543
Schistosoma mansoni hypothetical protein 0.0046 0.0222 0.0222
Plasmodium falciparum DNA topoisomerase 2 0.0083 0.0482 0.1728
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0083 0.0482 0.1728
Trypanosoma brucei DNA topoisomerase II beta, putative 0.0083 0.0482 0.1728
Echinococcus multilocularis pyruvate kinase 0.0019 0.0025 0.0025
Trypanosoma brucei heat shock protein, putative 0.0406 0.2792 1
Schistosoma mansoni heat shock protein 0.0406 0.2792 0.2792
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0021 0.004 0.0142
Giardia lamblia Kinase, PLK 0.0103 0.0628 0.2177
Onchocerca volvulus 0.0046 0.0222 0.1756
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0046 0.0222 0.0797
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0323 0.2201 0.5144
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0058 0.0308 0.072
Loa Loa (eye worm) hypothetical protein 0.0021 0.004 0.0142
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0021 0.004 0.0142
Schistosoma mansoni hypothetical protein 0.0043 0.0202 0.0202
Trichomonas vaginalis mismatch repair protein Mlh1C (mutL homolog) 0.0083 0.0482 0.1253
Mycobacterium ulcerans two component sensor kinase MprB 0.0083 0.0482 0.0801
Onchocerca volvulus Pyruvate kinase homolog 0.0036 0.0152 0.1075
Trypanosoma brucei heat shock protein 84, putative 0.0166 0.108 0.3868
Trypanosoma cruzi heat shock protein 85, putative 0.0323 0.2201 0.7884
Trichomonas vaginalis sensory transduction histidine kinase bacterial, putative 0.0083 0.0482 0.1253
Loa Loa (eye worm) hypothetical protein 0.0095 0.0572 0.2047
Trypanosoma cruzi polo-like protein kinase, putative 0.0103 0.0628 0.2248
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0083 0.0482 0.1127
Mycobacterium ulcerans two component regulator - sensor kinase 0.0083 0.0482 0.0801
Trichomonas vaginalis receptor histidine kinase, putative 0.0083 0.0482 0.1253
Trypanosoma brucei heat shock protein 90, putative 0.0406 0.2792 1
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Brugia malayi Nuclear hormone receptor-like 1 0.0021 0.004 0.0142
Echinococcus granulosus geminin 0.0163 0.1054 0.1054
Trichomonas vaginalis heat shock protein, putative 0.0323 0.2201 0.7763
Chlamydia trachomatis two component regulatory system sensor histidine kinase 0.0083 0.0482 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0021 0.004 0.004
Entamoeba histolytica heat shock transcription factor, putative 0.0095 0.0572 0.1834
Trypanosoma cruzi heat shock protein, putative 0.0166 0.108 0.3868
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.0234 0.0836
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.0083 0.0482 0.1728
Echinococcus multilocularis serine:threonine protein kinase PLK1 0.0103 0.0628 0.0628
Echinococcus granulosus FTZ F1 alpha 0.0021 0.004 0.004
Echinococcus multilocularis neuropeptide receptor A26 0.0446 0.3081 0.3081
Treponema pallidum heat shock protein 90 0.0323 0.2201 1
Onchocerca volvulus Heat shock protein 75 kDa, mitochondrial homolog 0.0166 0.108 1
Loa Loa (eye worm) transcription factor SMAD2 0.0115 0.071 0.2544
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0083 0.0482 0.4255
Echinococcus granulosus pyruvate kinase 0.0036 0.0152 0.0152
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Schistosoma mansoni hypothetical protein 0.0033 0.0125 0.0125
Echinococcus granulosus heat shock protein 90 0.0323 0.2201 0.2201
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0103 0.0628 0.0628
Echinococcus multilocularis thyroid hormone receptor alpha 0.0021 0.004 0.004
Brugia malayi Probable DNA topoisomerase II 0.0083 0.0482 0.1728
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0021 0.004 0.004
Trypanosoma cruzi heat shock protein 85, putative 0.0406 0.2792 1
Schistosoma mansoni hypothetical protein 0.0163 0.1054 0.1054
Echinococcus granulosus neuropeptide s receptor 0.0446 0.3081 0.3081
Onchocerca volvulus Serine\/threonine kinase homolog 0.0103 0.0628 0.565
Mycobacterium tuberculosis Possible two component sensor kinase 0.0083 0.0482 0.1127
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0021 0.004 0.0142
Loa Loa (eye worm) hypothetical protein 0.0021 0.004 0.0142
Plasmodium falciparum heat shock protein 90 0.0406 0.2792 1
Mycobacterium ulcerans two component sensor histidine kinase PrrB 0.0083 0.0482 0.0801
Trichomonas vaginalis CAMK family protein kinase 0.0051 0.0256 0.0395
Loa Loa (eye worm) MH2 domain-containing protein 0.0115 0.071 0.2544
Echinococcus granulosus heat shock protein 0.0406 0.2792 0.2792
Trichomonas vaginalis heat shock protein, putative 0.0323 0.2201 0.7763
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Echinococcus multilocularis endoplasmin 0.0323 0.2201 0.2201
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0083 0.0482 0.1728
Mycobacterium ulcerans DNA gyrase subunit B 0.0083 0.0482 0.0801
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0021 0.004 0.0142
Trichomonas vaginalis heat shock protein, putative 0.0406 0.2792 1
Toxoplasma gondii heat shock protein HSP90 0.0406 0.2792 1
Trichomonas vaginalis heat shock protein, putative 0.0166 0.108 0.3517
Loa Loa (eye worm) hypothetical protein 0.0025 0.0073 0.0261
Echinococcus granulosus ecdysone induced protein 78C 0.0021 0.004 0.004
Echinococcus multilocularis heat shock protein 75 kDa, mitochondrial 0.0166 0.108 0.108
Entamoeba histolytica hypothetical protein 0.0043 0.0202 0.0475
Trypanosoma cruzi heat shock protein 85, putative 0.0406 0.2792 1
Trichomonas vaginalis heat shock protein, putative 0.0249 0.1671 0.5754
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0058 0.0308 0.1103
Schistosoma mansoni aldehyde dehydrogenase 0.0058 0.0308 0.0308
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0021 0.004 0.004
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0021 0.004 0.004
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0083 0.0482 0.1728
Trichomonas vaginalis CAMK family protein kinase 0.0103 0.0628 0.1803
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0021 0.004 0.004
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0021 0.004 0.0142
Mycobacterium ulcerans sensor kinase from two component regulatory system 0.0083 0.0482 0.0801
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Schistosoma mansoni serine/threonine protein kinase 0.0103 0.0628 0.0628
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0103 0.0628 0.2248
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0058 0.0308 0.0308
Brugia malayi MH2 domain containing protein 0.0115 0.071 0.2544
Toxoplasma gondii aldehyde dehydrogenase 0.0058 0.0308 0.1103
Echinococcus granulosus neuropeptide receptor A26 0.0446 0.3081 0.3081
Trypanosoma cruzi polo-like protein kinase, putative 0.0103 0.0628 0.2248
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0043 0.0202 0.0202
Schistosoma mansoni heat shock protein 0.0166 0.108 0.108
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0021 0.004 0.0142
Trypanosoma cruzi heat shock protein 90, putative 0.024 0.1604 0.5743
Trypanosoma brucei DNA topoisomerase ii 0.0083 0.0482 0.1728
Brugia malayi hypothetical protein 0.0043 0.0202 0.0724
Schistosoma mansoni transcription factor LCR-F1 0.0043 0.0202 0.0202
Schistosoma mansoni pyruvate kinase 0.0036 0.0152 0.0152
Chlamydia trachomatis DNA gyrase subunit B 0.0083 0.0482 1
Entamoeba histolytica heat shock protein 90, putative 0.0406 0.2792 1
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0083 0.0482 0.0482
Trichomonas vaginalis CAMK family protein kinase 0.0103 0.0628 0.1803
Leishmania major DNA topoisomerase ii 0.0083 0.0482 0.1728
Brugia malayi Hsp90 protein 0.0166 0.108 0.3868
Mycobacterium tuberculosis Two component sensor kinase [second part] 0.0083 0.0482 0.1127
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.004 0.0142
Loa Loa (eye worm) pyruvate kinase 0.0036 0.0152 0.0543
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0021 0.004 0.004
Trypanosoma cruzi Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0083 0.0482 0.1728
Plasmodium vivax pyruvate kinase, putative 0.0036 0.0152 0.0543
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0083 0.0482 0.0482
Mycobacterium ulcerans two component system response phosphate sensor kinase, PhoR 0.0083 0.0482 0.0801
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.004 0.004
Trypanosoma brucei Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0083 0.0482 0.1728
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0083 0.0482 0.1728
Entamoeba histolytica heat shock transcription factor, putative 0.0095 0.0572 0.1834
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0021 0.004 0.0142
Toxoplasma gondii heat shock protein 75, putative 0.0166 0.108 0.3868
Leishmania major mitochondrial DNA topoisomerase II 0.0083 0.0482 0.1728
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.0234 0.0836
Echinococcus granulosus Pyruvate dehydrogenase lipoamide kinase 0.0083 0.0482 0.0482
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0021 0.004 0.004
Echinococcus granulosus heat shock protein 75 kDa mitochondrial 0.0166 0.108 0.108
Trypanosoma brucei heat shock protein, putative 0.0406 0.2792 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0021 0.004 0.0142
Trypanosoma brucei heat shock protein, putative 0.0406 0.2792 1
Brugia malayi Pyruvate kinase, M2 isozyme 0.0036 0.0152 0.0543
Plasmodium falciparum endoplasmin, putative 0.0249 0.1671 0.5984
Schistosoma mansoni DNA topoisomerase II 0.0083 0.0482 0.0482
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0021 0.004 0.004
Trichomonas vaginalis CAMK family protein kinase 0.0051 0.0256 0.0395
Loa Loa (eye worm) hypothetical protein 0.0021 0.004 0.0142
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0058 0.0308 0.0308
Brugia malayi photoreceptor-specific nuclear receptor 0.0021 0.004 0.0142
Trypanosoma brucei polo-like protein kinase 0.0103 0.0628 0.2248
Mycobacterium tuberculosis Two component sensor histidine kinase TrcS 0.0083 0.0482 0.1127
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0021 0.004 0.0142
Loa Loa (eye worm) hypothetical protein 0.0021 0.004 0.0142
Schistosoma mansoni nuclear hormone receptor 0.0021 0.004 0.004
Brugia malayi Steroid receptor seven-up type 2 0.0021 0.004 0.0142
Loa Loa (eye worm) hypothetical protein 0.0021 0.004 0.0142
Loa Loa (eye worm) heat shock protein 90 0.0406 0.2792 1
Trypanosoma brucei Heat shock protein 83, putative 0.0406 0.2792 1
Schistosoma mansoni hypothetical protein 0.0163 0.1054 0.1054
Trichomonas vaginalis CAMK family protein kinase 0.0103 0.0628 0.1803
Brugia malayi hypothetical protein 0.0227 0.1513 0.542
Schistosoma mansoni endoplasmin 0.0406 0.2792 0.2792
Echinococcus multilocularis heat shock protein 90 0.0323 0.2201 0.2201
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0083 0.0482 0.1728
Schistosoma mansoni steroid hormone receptor ad4bp 0.0021 0.004 0.004
Trypanosoma brucei pyruvate kinase 1, putative 0.0036 0.0152 0.0543
Trypanosoma cruzi heat shock protein 90, putative 0.0323 0.2201 0.7884
Leishmania major heat shock protein 83-1 0.0406 0.2792 1
Loa Loa (eye worm) pyruvate kinase 0.0036 0.0152 0.0543
Mycobacterium leprae Probable two-component sensor kinase 0.0083 0.0482 0.1614
Brugia malayi nuclear receptor NHR-88 0.0021 0.004 0.0142
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0021 0.004 0.004
Loa Loa (eye worm) heat shock protein 75 0.0166 0.108 0.3868
Echinococcus granulosus pyruvate kinase 0.0019 0.0025 0.0025
Brugia malayi kinase, mitochondrial precursor 0.0083 0.0482 0.1728
Echinococcus granulosus pyruvate kinase 0.0019 0.0025 0.0025
Mycobacterium leprae TWO COMPONENT SENSOR HISTIDINE KINASE PRRB 0.0083 0.0482 0.1614
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0021 0.004 0.0142
Onchocerca volvulus Pyruvate kinase homolog 0.0036 0.0152 0.1075
Mycobacterium ulcerans aldehyde dehydrogenase 0.0058 0.0308 0.0379
Mycobacterium ulcerans heat shock protein 90 0.0323 0.2201 0.4965
Trypanosoma brucei heat shock protein, putative 0.0406 0.2792 1
Loa Loa (eye worm) pyruvate kinase-PB 0.0025 0.0073 0.0261
Trypanosoma cruzi Heat shock protein 83, putative 0.0406 0.2792 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0021 0.004 0.004
Echinococcus multilocularis neuropeptide s receptor 0.0446 0.3081 0.3081
Trichomonas vaginalis receptor histidine kinase, putative 0.0083 0.0482 0.1253
Plasmodium falciparum heat shock protein 90, putative 0.0166 0.108 0.3868
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0125 0.0449

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.5623 uM PubChem BioAssay. qHTS of Nrf2 Activators. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 2.0596 uM PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] ChEMBL. No reference
Potency (functional) 5.8584 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 18.3489 uM PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] 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) 100 uM PUBCHEM_BIOASSAY: Inhibitors of TCP-1 ring complex (TRiC) of Methanococcus maripaludis (MmCpn): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488991] 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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