Detailed information for compound 1329693

Basic information

Technical information
  • TDR Targets ID: 1329693
  • Name: 1-(2,4-dihydroxyphenyl)-2-(1,3-thiazol-4-yl)e thanone
  • MW: 235.259 | Formula: C11H9NO3S
  • H donors: 2 H acceptors: 4 LogP: 2.11 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Oc1ccc(c(c1)O)C(=O)Cc1cscn1
  • InChi: 1S/C11H9NO3S/c13-8-1-2-9(11(15)4-8)10(14)3-7-5-16-6-12-7/h1-2,4-6,13,15H,3H2
  • InChiKey: HSILQTPMMDYSRP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-(2,4-dihydroxyphenyl)-2-thiazol-4-yl-ethanone
  • 1-(2,4-dihydroxyphenyl)-2-(4-thiazolyl)ethanone
  • IFLab1_000420
  • ZINC00408888
  • STOCK1S-27586
  • Oprea1_847826
  • MLS000038401
  • SMR000038991
  • IFLab2_000187
  • IDI1_019213
  • IDI1_008639
  • Oprea1_288456

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens pyruvate kinase, muscle Starlite/ChEMBL No references
Human immunodeficiency virus 1 Aberrant vpr protein Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Plasmodium falciparum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium knowlesi pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania major pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania infantum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126685 All targets in OG5_126685
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma congolense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase-PB Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania mexicana pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium vivax pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei gambiense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma cruzi pyruvate kinase 2, putative Get druggable targets OG5_126685 All targets in OG5_126685
Candida albicans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Giardia lamblia Pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trichomonas vaginalis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi Pyruvate kinase, M2 isozyme Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma japonicum Pyruvate kinase isozyme R, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania major pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus granulosus pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium tuberculosis Probable pyruvate kinase PykA Get druggable targets OG5_126685 All targets in OG5_126685
Brugia malayi Pyruvate kinase, muscle isozyme Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania infantum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium berghei pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania donovani pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Chlamydia trachomatis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Babesia bovis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus granulosus pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Plasmodium yoelii pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Toxoplasma gondii pyruvate kinase PyK1 Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma cruzi pyruvate kinase 2, putative Get druggable targets OG5_126685 All targets in OG5_126685
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Cryptosporidium hominis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium leprae Probable pyruvate kinase PykA Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma mansoni pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania mexicana pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Echinococcus multilocularis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trichomonas vaginalis pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei gambiense pyruvate kinase 1, putative Get druggable targets OG5_126685 All targets in OG5_126685
Theileria parva pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Entamoeba histolytica pyruvate kinase, putative Get druggable targets OG5_126685 All targets in OG5_126685
Candida albicans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Leishmania braziliensis pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126685 All targets in OG5_126685
Schistosoma japonicum ko:K00873 pyruvate kinase [EC2.7.1.40], putative Get druggable targets OG5_126685 All targets in OG5_126685
Mycobacterium ulcerans pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Loa Loa (eye worm) pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Trypanosoma brucei pyruvate kinase 1 Get druggable targets OG5_126685 All targets in OG5_126685
Cryptosporidium parvum pyruvate kinase Get druggable targets OG5_126685 All targets in OG5_126685
Onchocerca volvulus Pyruvate kinase homolog Get druggable targets OG5_126685 All targets in OG5_126685
Neospora caninum Pyruvate kinase (EC 2.7.1.40), related Get druggable targets OG5_126685 All targets in OG5_126685
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Echinococcus granulosus pyruvate kinase pyruvate kinase, muscle 605 aa 521 aa 34.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni cellular tumor antigen P53 0.0049 0.0377 0.0128
Loa Loa (eye worm) hypothetical protein 0.0049 0.0377 0.0378
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0138 0.1707 0.2124
Loa Loa (eye worm) pyruvate kinase 0.004 0.0252 0.0253
Loa Loa (eye worm) endoplasmin 0.0693 0.9963 1
Leishmania major DNA topoisomerase ii 0.0138 0.1707 0.1714
Loa Loa (eye worm) heat shock protein 75 0.0352 0.489 0.4908
Schistosoma mansoni DNA topoisomerase II 0.0138 0.1707 0.1493
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0138 0.1707 0.1498
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0138 0.1707 0.3491
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0563 0.8037 1
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0555 0.7909 0.7855
Trichomonas vaginalis mismatch repair protein Mlh1C (mutL homolog) 0.0138 0.1707 0.1498
Mycobacterium leprae Probable two-component sensor kinase 0.0138 0.1707 0.2124
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Leishmania major mitochondrial DNA topoisomerase II 0.0138 0.1707 0.1714
Trypanosoma cruzi heat shock protein 85, putative 0.0693 0.9963 1
Toxoplasma gondii pyruvate dehydrogenase kinase, putative 0.0047 0.0358 0.0109
Mycobacterium tuberculosis Probable sensor protein KdpD 0.0138 0.1707 0.2124
Toxoplasma gondii heat shock protein 90, putative 0.0693 0.9963 1
Plasmodium falciparum DNA gyrase subunit B 0.0138 0.1707 0.1498
Mycobacterium tuberculosis Two component sensor kinase MprB 0.0138 0.1707 0.2124
Loa Loa (eye worm) TOPoisomerase family member 0.0138 0.1707 0.1714
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0138 0.1707 0.3491
Echinococcus granulosus heat shock protein 0.0693 0.9963 0.9962
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Trypanosoma cruzi DNA topoisomerase II, putative 0.0138 0.1707 0.1498
Trypanosoma cruzi heat shock protein 90, putative 0.04 0.5606 0.5513
Trichomonas vaginalis endoplasmin, putative 0.0431 0.6064 0.5985
Loa Loa (eye worm) heat shock protein 90 0.0693 0.9963 1
Trichomonas vaginalis sensor histidine kinase, putative 0.0138 0.1707 0.1498
Echinococcus granulosus heat shock protein 75 kDa mitochondrial 0.0352 0.489 0.4758
Mycobacterium ulcerans pyruvate kinase 0.004 0.0252 0.0314
Echinococcus granulosus tumor protein p63 0.0332 0.46 0.446
Trypanosoma cruzi Heat shock protein 83, putative 0.0693 0.9963 1
Mycobacterium tuberculosis Two component sensor histidine kinase TrcS 0.0138 0.1707 0.2124
Echinococcus granulosus Pyruvate dehydrogenase lipoamide kinase 0.0266 0.3613 0.3448
Plasmodium vivax hypothetical protein, conserved 0.0138 0.1707 0.1498
Trichomonas vaginalis receptor histidine kinase, putative 0.0138 0.1707 0.1498
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0563 0.8037 0.8067
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0266 0.3613 0.3532
Loa Loa (eye worm) pyruvate kinase 0.004 0.0252 0.0253
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Trypanosoma brucei heat shock protein, putative 0.0693 0.9963 1
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0138 0.1707 0.2124
Schistosoma mansoni pyruvate dehydrogenase 0.0266 0.3613 0.3448
Mycobacterium ulcerans two component system membrane associated sensor kinase 0.0138 0.1707 0.2124
Loa Loa (eye worm) pyruvate kinase 0.004 0.0252 0.0253
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Trichomonas vaginalis sensory transduction histidine kinase, putative 0.0138 0.1707 0.1498
Trypanosoma cruzi heat shock protein 90, putative 0.0555 0.7909 0.7884
Leishmania major pyruvate kinase 0.004 0.0252 0.0253
Trypanosoma brucei heat shock protein 84, putative 0.0352 0.489 0.4776
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0138 0.1707 0.1498
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0138 0.1707 0.2124
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Leishmania major pyruvate dehydrogenase (lipoamide) kinase, putative 0.0047 0.0358 0.036
Mycobacterium ulcerans two component system response phosphate sensor kinase, PhoR 0.0138 0.1707 0.2124
Brugia malayi Hsp90 protein 0.0352 0.489 0.4908
Brugia malayi Endoplasmin precursor 0.0693 0.9963 1
Trypanosoma cruzi pyruvate dehydrogenase (lipoamide) kinase, putative 0.0047 0.0358 0.0109
Leishmania major heat shock protein, putative 0.0352 0.489 0.4908
Brugia malayi kinase, mitochondrial precursor 0.0266 0.3613 0.3626
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0185 0.2413 0.2225
Schistosoma mansoni pyruvate dehydrogenase 0.0128 0.1559 0.134
Loa Loa (eye worm) hypothetical protein 0.0138 0.1707 0.1714
Echinococcus multilocularis pyruvate kinase 0.004 0.0252 0.0128
Loa Loa (eye worm) hypothetical protein 0.0266 0.3613 0.3626
Trypanosoma brucei Heat shock protein 83, putative 0.0693 0.9963 1
Echinococcus multilocularis heat shock protein 75 kDa, mitochondrial 0.0352 0.489 0.4825
Entamoeba histolytica DNA topoisomerase II, putative 0.0138 0.1707 0.1714
Trypanosoma brucei heat shock protein, putative 0.0693 0.9963 1
Chlamydia trachomatis DNA gyrase subunit B 0.0138 0.1707 1
Echinococcus multilocularis heat shock protein 90 0.0555 0.7909 0.7882
Onchocerca volvulus Pyruvate kinase homolog 0.004 0.0252 0.0516
Trypanosoma brucei heat shock protein, putative 0.0693 0.9963 1
Mycobacterium ulcerans two component sensor histidine kinase TrcS 0.0138 0.1707 0.2124
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Mycobacterium ulcerans two component sensory transduction histidine kinase MtrB 0.0138 0.1707 0.2124
Toxoplasma gondii DNA topoisomerase 2, putative 0.0138 0.1707 0.1498
Mycobacterium ulcerans putative regultory protein 0.0138 0.1707 0.2124
Trypanosoma brucei heat shock protein, putative 0.0693 0.9963 1
Echinococcus granulosus heat shock protein 90 0.0555 0.7909 0.7855
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Onchocerca volvulus Heat shock protein 75 kDa, mitochondrial homolog 0.0352 0.489 1
Chlamydia trachomatis DNA gyrase subunit B 0.0138 0.1707 1
Trichomonas vaginalis heat shock protein, putative 0.0563 0.8037 0.8017
Entamoeba histolytica 90 kDa heat shock protein, putative 0.0301 0.4139 0.4154
Plasmodium vivax heat shock protein 86, putative 0.0693 0.9963 1
Mycobacterium ulcerans DNA gyrase subunit B 0.0138 0.1707 0.2124
Loa Loa (eye worm) hypothetical protein 0.0138 0.1707 0.1714
Trichomonas vaginalis heat shock protein, putative 0.0293 0.401 0.387
Schistosoma mansoni heat shock protein 0.0693 0.9963 0.9962
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0138 0.1707 0.2124
Entamoeba histolytica heat shock protein 90, putative 0.0693 0.9963 1
Mycobacterium tuberculosis Two component sensor kinase [second part] 0.0138 0.1707 0.2124
Mycobacterium leprae Probable two component sensor kinase MprB 0.0138 0.1707 0.2124
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Mycobacterium tuberculosis Probable two component sensor kinase 0.0138 0.1707 0.2124
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0138 0.1707 0.1498
Trypanosoma cruzi Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0138 0.1707 0.1498
Giardia lamblia Heat shock protein HSP 90-alpha 0.0555 0.7909 0.7884
Entamoeba histolytica heat shock protein 90, putative 0.0693 0.9963 1
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0138 0.1707 0.1714
Mycobacterium leprae PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3 0.0138 0.1707 0.2124
Leishmania major developmentally regulated phosphoprotein-like protein 0.0266 0.3613 0.3626
Echinococcus multilocularis heat shock protein 90 0.0693 0.9963 0.9963
Brugia malayi heat shock protein 90 0.0693 0.9963 1
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Echinococcus multilocularis heat shock protein 0.0693 0.9963 0.9963
Echinococcus multilocularis endoplasmin 0.0563 0.8037 0.8012
Trichomonas vaginalis heat shock protein, putative 0.0555 0.7909 0.7884
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Mycobacterium tuberculosis Two component sensory transduction histidine kinase MtrB 0.0138 0.1707 0.2124
Loa Loa (eye worm) hypothetical protein 0.0028 0.0071 0.0071
Mycobacterium ulcerans two component sensor histidine kinase PrrB 0.0138 0.1707 0.2124
Trypanosoma cruzi developmentally regulated phosphoprotein, putative 0.0266 0.3613 0.3461
Echinococcus granulosus endoplasmin 0.0563 0.8037 0.7986
Mycobacterium ulcerans two component sensor histidine kinase SenX3 0.0138 0.1707 0.2124
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Trypanosoma brucei heat shock protein, putative 0.0693 0.9963 1
Trichomonas vaginalis two component sensor and regulator histidine kinase bacteria, putative 0.0138 0.1707 0.1498
Schistosoma mansoni pyruvate dehydrogenase 0.0128 0.1559 0.134
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0563 0.8037 1
Onchocerca volvulus Pyruvate kinase homolog 0.004 0.0252 0.0516
Trypanosoma brucei heat shock protein, putative 0.0693 0.9963 1
Entamoeba histolytica pyruvate kinase, putative 0.0028 0.0071 0.0071
Mycobacterium ulcerans sensor kinase from two component regulatory system 0.0138 0.1707 0.2124
Plasmodium vivax endoplasmin, putative 0.0693 0.9963 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0252 0.0253
Echinococcus multilocularis microtubule associated protein 2 0.0695 1 1
Trichomonas vaginalis heat shock protein, putative 0.0563 0.8037 0.8017
Plasmodium falciparum DNA topoisomerase VI, b subunit, putative 0.0138 0.1707 0.1498
Chlamydia trachomatis two component regulatory system sensor histidine kinase 0.0138 0.1707 1
Giardia lamblia Grp94/Hsp90 0.0563 0.8037 0.8017
Toxoplasma gondii heat shock protein HSP90 0.0693 0.9963 1
Trypanosoma cruzi heat shock protein 90, putative 0.0693 0.9963 1
Echinococcus granulosus heat shock protein 90 0.0693 0.9963 0.9962
Schistosoma mansoni endoplasmin 0.0693 0.9963 0.9962
Echinococcus multilocularis tumor protein p63 0.0332 0.46 0.4531
Trypanosoma brucei DNA topoisomerase II beta, putative 0.0138 0.1707 0.1498
Plasmodium vivax DNA topoisomerase II, putative 0.0138 0.1707 0.1498
Trypanosoma brucei Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0138 0.1707 0.1498
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Plasmodium falciparum heat shock protein 90, putative 0.0301 0.4139 0.4002
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) 0.0563 0.8037 1
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.004 0.0252 0.0314
Plasmodium vivax DNA gyrase subunit B, putative 0.0138 0.1707 0.1498
Mycobacterium ulcerans heat shock protein 90 0.0563 0.8037 1
Trypanosoma cruzi heat shock protein 85, putative 0.0693 0.9963 1
Giardia lamblia Pms1-like protein 0.0138 0.1707 0.1498
Trypanosoma brucei heat shock protein 90, putative 0.0693 0.9963 1
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Toxoplasma gondii Hsp90 domain-containing protein 0.0301 0.4139 0.4002
Plasmodium vivax heat shock protein, putative 0.0301 0.4139 0.4002
Mycobacterium leprae Probable pyruvate kinase PykA 0.004 0.0252 0.0314
Trypanosoma brucei heat shock protein, putative 0.0693 0.9963 1
Trypanosoma cruzi heat shock protein 85, putative 0.0555 0.7909 0.7884
Schistosoma mansoni endoplasmin 0.0693 0.9963 0.9962
Mycobacterium tuberculosis Two component sensor histidine kinase PrrB 0.0138 0.1707 0.2124
Plasmodium falciparum heat shock protein 90 0.0693 0.9963 1
Trypanosoma brucei heat shock protein 90, putative 0.0693 0.9963 1
Plasmodium vivax heat shock protein 90, putative 0.0352 0.489 0.4776
Treponema pallidum heat shock protein 90 0.0563 0.8037 1
Mycobacterium tuberculosis Possible two component system response sensor kinase membrane associated PhoR 0.0138 0.1707 0.2124
Leishmania major pyruvate kinase 0.004 0.0252 0.0253
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0138 0.1707 0.3491
Trypanosoma cruzi DNA topoisomerase II, putative 0.0138 0.1707 0.1498
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0138 0.1707 0.1493
Schistosoma mansoni heat shock protein 0.0693 0.9963 0.9962
Trypanosoma brucei DNA topoisomerase ii 0.0138 0.1707 0.1498
Leishmania major hypothetical protein, conserved 0.0138 0.1707 0.1714
Mycobacterium tuberculosis Possible two component sensor kinase TcrY 0.0138 0.1707 0.2124
Trichomonas vaginalis heat shock protein, putative 0.0431 0.6064 0.5985
Brugia malayi Probable DNA topoisomerase II 0.0138 0.1707 0.1714
Trypanosoma brucei heat shock protein, putative 0.0693 0.9963 1
Trichomonas vaginalis sensory transduction histidine kinase bacterial, putative 0.0138 0.1707 0.1498
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0138 0.1707 0.1714
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0138 0.1707 0.1601
Onchocerca volvulus 0.0049 0.0377 0.0771
Plasmodium falciparum endoplasmin, putative 0.0431 0.6064 0.5985
Brugia malayi Pyruvate kinase, muscle isozyme 0.004 0.0252 0.0253
Trypanosoma brucei pyruvate dehydrogenase (lipoamide) kinase, putative 0.0047 0.0358 0.0109
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0138 0.1707 0.1498
Mycobacterium tuberculosis Possible two component sensor kinase 0.0138 0.1707 0.2124
Schistosoma mansoni microtubule-associated protein tau 0.0695 1 1
Echinococcus multilocularis pyruvate kinase 0.004 0.0252 0.0128
Trypanosoma cruzi heat shock protein 85, putative 0.0693 0.9963 1
Trichomonas vaginalis DNA topoisomerase II, putative 0.0138 0.1707 0.1498
Toxoplasma gondii heat shock protein 75, putative 0.0352 0.489 0.4776
Plasmodium falciparum heat shock protein 90, putative 0.0343 0.4762 0.4644
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.0138 0.1707 0.1498
Trypanosoma cruzi heat shock protein, putative 0.0352 0.489 0.4776
Plasmodium falciparum DNA topoisomerase 2 0.0138 0.1707 0.1498
Trichomonas vaginalis receptor histidine kinase, putative 0.0138 0.1707 0.1498
Mycobacterium ulcerans two component regulator - sensor kinase 0.0138 0.1707 0.2124
Mycobacterium ulcerans two component sensor kinase MprB 0.0138 0.1707 0.2124
Giardia lamblia Heat shock protein HSP 90-alpha 0.0693 0.9963 1
Mycobacterium tuberculosis Conserved protein 0.0138 0.1707 0.2124
Onchocerca volvulus Pyruvate kinase homolog 0.004 0.0252 0.0516
Brugia malayi Pyruvate kinase, M2 isozyme 0.004 0.0252 0.0253
Schistosoma mansoni heat shock protein 0.0352 0.489 0.4758
Trichomonas vaginalis sensory transduction histidine kinase bacterial, putative 0.0138 0.1707 0.1498
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.0266 0.3613 0.3532
Trypanosoma brucei developmentally regulated phosphoprotein 0.0266 0.3613 0.3461
Mycobacterium leprae TWO COMPONENT SENSOR HISTIDINE KINASE PRRB 0.0138 0.1707 0.2124
Leishmania major heat shock protein 83-1 0.0693 0.9963 1
Loa Loa (eye worm) pyruvate kinase-PB 0.0028 0.0071 0.0071
Trichomonas vaginalis heat shock protein, putative 0.0693 0.9963 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 7.9433 uM PubChem BioAssay. qHTS Assay for Inhibitors of the HIV-1 protein Vpr. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Activators of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 17.7828 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Muscle isoform 2 Pyruvate Kinase. (Class of assay: confirmatory) [Related pubchem assays: 1379 ] ChEMBL. No reference
Potency (functional) 18.526 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) 28.1838 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) 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

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.
 
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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