Detailed information for compound 1373619

Basic information

Technical information
  • TDR Targets ID: 1373619
  • Name: N-(1,3-Benzodioxol-5-ylmethyl)-4-bromobenzami de
  • MW: 334.165 | Formula: C15H12BrNO3
  • H donors: 1 H acceptors: 1 LogP: 3.2 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Brc1ccc(cc1)C(=O)NCc1ccc2c(c1)OCO2
  • InChi: 1S/C15H12BrNO3/c16-12-4-2-11(3-5-12)15(18)17-8-10-1-6-13-14(7-10)20-9-19-13/h1-7H,8-9H2,(H,17,18)
  • InChiKey: RUOJBMYYQISPAI-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-benzamide
  • Benzamide, 4-bromo-N-(3,4-methylenedioxybenzyl)-
  • Oprea1_522742
  • BAS 00395042
  • MLS001207268
  • SMR000513857
  • ST005962
  • Oprea1_270300
  • N-Benzo[1,3]dioxol-5-ylmethyl-4-bromo-benzamide
  • ZINC00035980

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Plasmodium falciparum heat shock protein 90, putative Starlite/ChEMBL No references
Influenza A virus Nonstructural protein 1 Starlite/ChEMBL No references
Homo sapiens TAR DNA binding protein Starlite/ChEMBL No references
Homo sapiens heat shock protein 90kDa alpha (cytosolic), class A member 1 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Giardia lamblia Grp94/Hsp90 Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma japonicum ko:K09487 heat shock protein 90kDa beta, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania braziliensis heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium yoelii heat shock protein 83 Get druggable targets OG5_144951 All targets in OG5_144951
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania infantum lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative Get druggable targets OG5_126623 All targets in OG5_126623
Babesia bovis heat shock protein 90 Get druggable targets OG5_144951 All targets in OG5_144951
Trypanosoma brucei heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Toxoplasma gondii Hsp90 domain-containing protein Get druggable targets OG5_144951 All targets in OG5_144951
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus granulosus endoplasmin Get druggable targets OG5_126623 All targets in OG5_126623
Candida albicans hypothetical protein Get druggable targets OG5_126623 All targets in OG5_126623
Brugia malayi Endoplasmin precursor Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania braziliensis lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative Get druggable targets OG5_126623 All targets in OG5_126623
Loa Loa (eye worm) endoplasmin Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus multilocularis tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Giardia lamblia Heat shock protein HSP 90-alpha Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium yoelii heat shock 90 kDa protein homolog Get druggable targets OG5_126623 All targets in OG5_126623
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium yoelii heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma congolense heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma japonicum Heat shock protein HSP 90-beta, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma cruzi heat shock protein 85, putative Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus granulosus heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma cruzi heat shock protein 85, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Neospora caninum heat shock protein 90, putative Get druggable targets OG5_144951 All targets in OG5_144951
Schistosoma mansoni endoplasmin Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium berghei heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania braziliensis heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus multilocularis heat shock protein Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium vivax endoplasmin, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania donovani heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Brugia malayi RNA recognition motif domain containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma cruzi heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Plasmodium falciparum heat shock protein 90, putative Get druggable targets OG5_144951 All targets in OG5_144951
Mycobacterium ulcerans heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Brugia malayi heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei gambiense lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative Get druggable targets OG5_126623 All targets in OG5_126623
Neospora caninum HSP90, related Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus granulosus tar DNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma brucei gambiense Heat shock protein 83, putative Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium knowlesi heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma japonicum Heat shock protein HSP 90-alpha, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania braziliensis heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania infantum heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium vivax heat shock protein, putative Get druggable targets OG5_144951 All targets in OG5_144951
Leishmania infantum heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium knowlesi heat shock protein 90, putative Get druggable targets OG5_144951 All targets in OG5_144951
Loa Loa (eye worm) RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Loa Loa (eye worm) TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Echinococcus granulosus heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium falciparum heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni endoplasmin Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania donovani heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Treponema pallidum heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Cryptosporidium parvum Hsp90 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni heat shock protein Get druggable targets OG5_126623 All targets in OG5_126623
Candida albicans heat shock protein Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus multilocularis heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein Get druggable targets OG5_132461 All targets in OG5_132461
Trypanosoma brucei heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Cryptosporidium hominis heat shock protein 83 Get druggable targets OG5_126623 All targets in OG5_126623
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania mexicana heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Theileria parva heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma cruzi heat shock protein 85, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma congolense heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Candida albicans heat shock protein Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei gambiense Heat shock protein 83, putative Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma japonicum Heat shock protein 83, putative Get druggable targets OG5_126623 All targets in OG5_126623
Toxoplasma gondii heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium berghei heat shock protein 90, putative Get druggable targets OG5_144951 All targets in OG5_144951
Trypanosoma brucei heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma japonicum IPR003367,Thrombospondin type 3 repeat;IPR002048,Calcium-binding EF-hand,domain-containing Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma cruzi heat shock protein 85, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Neospora caninum HSP90-like protein, related Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei gambiense heat shock protein 83,heat shock protein Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus granulosus heat shock protein heat shock protein 90 alpha Get druggable targets OG5_126623 All targets in OG5_126623
Entamoeba histolytica heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Loa Loa (eye worm) heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei Heat shock protein 83, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma cruzi Heat shock protein 83, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma cruzi heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania mexicana heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni tar DNA-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Brugia malayi TAR-binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Brugia malayi RNA binding protein Get druggable targets OG5_132461 All targets in OG5_132461
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Theileria parva heat shock protein 90, putative Get druggable targets OG5_144951 All targets in OG5_144951
Schistosoma japonicum ko:K04079 molecular chaperone HtpG, putative Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus multilocularis endoplasmin Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma japonicum TAR DNA-binding protein 43, putative Get druggable targets OG5_132461 All targets in OG5_132461
Babesia bovis hsp90 protein Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania mexicana lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus granulosus heat shock protein Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium knowlesi endoplasmin, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium vivax heat shock protein 86, putative Get druggable targets OG5_126623 All targets in OG5_126623
Toxoplasma gondii heat shock protein HSP90 Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Giardia lamblia Heat shock protein HSP 90-alpha Get druggable targets OG5_126623 All targets in OG5_126623
Entamoeba histolytica heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni heat shock protein Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania infantum heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus multilocularis heat shock protein 90 Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium yoelii putative heat shock protein 81-2 Get druggable targets OG5_126623 All targets in OG5_126623
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma brucei heat shock protein, putative Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma cruzi heat shock protein 90, putative Get druggable targets OG5_126623 All targets in OG5_126623
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Trypanosoma congolense Heat shock protein 83, putative Get druggable targets OG5_126623 All targets in OG5_126623
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Mycobacterium tuberculosis Hypothetical protein Nonstructural protein 1   230 aa 202 aa 23.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Schistosoma mansoni endoplasmin 0.0055 0.0048 0.0038
Trypanosoma brucei heat shock protein, putative 0.0055 0.0048 0.3371
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0092 0.0123 1
Toxoplasma gondii heat shock protein 90, putative 0.0055 0.0048 0.1074
Schistosoma mansoni ceramide glucosyltransferase 0.489 1 1
Trypanosoma brucei heat shock protein, putative 0.0055 0.0048 0.3371
Toxoplasma gondii heat shock protein HSP90 0.0055 0.0048 0.1074
Brugia malayi TAR-binding protein 0.0076 0.0091 0.0082
Loa Loa (eye worm) TAR-binding protein 0.0076 0.0091 0.0082
Trichomonas vaginalis heat shock protein, putative 0.004 0.0016 0.345
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Trypanosoma brucei heat shock protein, putative 0.0055 0.0048 0.3371
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) 0.0052 0.0041 0.5
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0091 0.0082
Trypanosoma cruzi cytochrome P450, putative 0.0092 0.0123 1
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0047 0.0031 0.0022
Brugia malayi Endoplasmin precursor 0.0055 0.0048 0.0038
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0052 0.0041 0.5
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.0091 0.0082
Echinococcus granulosus heat shock protein 0.0055 0.0048 0.0038
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Plasmodium falciparum heat shock protein 90 0.0055 0.0048 0.1305
Trypanosoma brucei Heat shock protein 83, putative 0.0055 0.0048 0.3371
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Plasmodium vivax heat shock protein 86, putative 0.0055 0.0048 0.1074
Trypanosoma cruzi heat shock protein 85, putative 0.0055 0.0048 0.3371
Loa Loa (eye worm) cytochrome P450 family protein 0.0092 0.0123 0.0114
Echinococcus granulosus endoplasmin 0.0052 0.0041 0.0031
Trypanosoma cruzi heat shock protein 85, putative 0.0055 0.0048 0.3371
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Trypanosoma brucei heat shock protein, putative 0.0055 0.0048 0.3371
Trypanosoma cruzi cytochrome P450, putative 0.0092 0.0123 1
Entamoeba histolytica heat shock protein 90, putative 0.0055 0.0048 1
Echinococcus multilocularis heat shock protein 0.0055 0.0048 0.0038
Echinococcus multilocularis endoplasmin 0.0052 0.0041 0.0031
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Loa Loa (eye worm) endoplasmin 0.0055 0.0048 0.0038
Onchocerca volvulus Ceramide glucosyltransferase homolog 0.489 1 1
Trypanosoma cruzi Heat shock protein 83, putative 0.0055 0.0048 0.3371
Trichomonas vaginalis heat shock protein, putative 0.0055 0.0048 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0091 0.0082
Trichomonas vaginalis heat shock protein, putative 0.0052 0.0041 0.8533
Schistosoma mansoni ceramide glucosyltransferase 0.489 1 1
Trypanosoma brucei heat shock protein, putative 0.0055 0.0048 0.3371
Echinococcus multilocularis heat shock protein 90 0.0047 0.0031 0.0022
Schistosoma mansoni heat shock protein 0.0055 0.0048 0.0038
Trypanosoma cruzi heat shock protein 90, putative 0.0047 0.0031 0.192
Trypanosoma brucei heat shock protein, putative 0.0055 0.0048 0.3371
Leishmania major cytochrome p450-like protein 0.0092 0.0123 1
Echinococcus multilocularis ceramide glucosyltransferase 0.489 1 1
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Brugia malayi RNA binding protein 0.0076 0.0091 0.0082
Trypanosoma brucei heat shock protein 90, putative 0.0055 0.0048 0.3371
Giardia lamblia Ceramide glucosyltransferase 0.2217 0.4497 1
Trypanosoma brucei heat shock protein 90, putative 0.0055 0.0048 0.3371
Echinococcus granulosus tar DNA binding protein 0.0076 0.0091 0.0082
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0052 0.0041 0.2754
Brugia malayi heat shock protein 90 0.0055 0.0048 0.0038
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Trypanosoma cruzi heat shock protein 85, putative 0.0047 0.0031 0.192
Trypanosoma brucei heat shock protein, putative 0.0055 0.0048 0.3371
Plasmodium falciparum endoplasmin, putative 0.004 0.0016 0.045
Trichomonas vaginalis heat shock protein, putative 0.0052 0.0041 0.8533
Plasmodium falciparum heat shock protein 90, putative 0.021 0.0365 1
Trypanosoma brucei cytochrome P450, putative 0.0092 0.0123 1
Plasmodium vivax heat shock protein, putative 0.021 0.0365 1
Echinococcus granulosus heat shock protein 90 0.0047 0.0031 0.0022
Trypanosoma cruzi heat shock protein 85, putative 0.0055 0.0048 0.3371
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0052 0.0041 0.5
Echinococcus multilocularis heat shock protein 90 0.0055 0.0048 0.0038
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Loa Loa (eye worm) ceramide glucosyltransferase 0.489 1 1
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0091 0.0082
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Trypanosoma cruzi heat shock protein 90, putative 0.0055 0.0048 0.3371
Plasmodium vivax endoplasmin, putative 0.0055 0.0048 0.1074
Schistosoma mansoni endoplasmin 0.0055 0.0048 0.0038
Loa Loa (eye worm) heat shock protein 90 0.0055 0.0048 0.0038
Loa Loa (eye worm) cytochrome P450 family protein 0.0092 0.0123 0.0114
Loa Loa (eye worm) RNA binding protein 0.0076 0.0091 0.0082
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.0091 0.0082
Loa Loa (eye worm) CYP4Cod1 0.0092 0.0123 0.0114
Echinococcus granulosus heat shock protein 90 0.0055 0.0048 0.0038
Trichomonas vaginalis endoplasmin, putative 0.004 0.0016 0.345
Loa Loa (eye worm) hypothetical protein 0.0065 0.0068 0.0059
Brugia malayi Cytochrome P450 family protein 0.0092 0.0123 0.0114
Trichomonas vaginalis heat shock protein, putative 0.0047 0.0031 0.655
Giardia lamblia Grp94/Hsp90 0.0052 0.0041 0.0021
Echinococcus multilocularis tar DNA binding protein 0.0076 0.0091 0.0082
Toxoplasma gondii Hsp90 domain-containing protein 0.021 0.0365 1
Giardia lamblia Heat shock protein HSP 90-alpha 0.0055 0.0048 0.0037
Treponema pallidum heat shock protein 90 0.0052 0.0041 0.5
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0091 0.0082
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0091 0.0082
Schistosoma mansoni heat shock protein 0.0055 0.0048 0.0038
Brugia malayi Cytochrome P450 family protein 0.0092 0.0123 0.0114
Entamoeba histolytica heat shock protein 90, putative 0.0055 0.0048 1
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Leishmania major heat shock protein 83-1 0.0055 0.0048 0.3371
Trypanosoma brucei heat shock protein, putative 0.0055 0.0048 0.3371
Echinococcus granulosus ceramide glucosyltransferase 0.489 1 1

Activities

Activity type Activity value Assay description Source Reference
AC50 (functional) = 4.379 uM PUBCHEM_BIOASSAY: HsHsp90 Counterscreen Measured in Microorganism System Using Plate Reader - 2121-02_Inhibitor_Dose_CherryPick_Activity. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504596] ChEMBL. No reference
AC50 (functional) = 4.457 uM PUBCHEM_BIOASSAY: Anti-Malarial Hsp90 Inhibitors Measured in Microorganism System Using Plate Reader - 2121-01_Inhibitor_Dose_CherryPick_Activity. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504596] ChEMBL. No reference
Potency (functional) 0.8913 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 4.1475 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) = 11.2202 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Influenza NS1 Protein Function. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 15.8489 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

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23
Homo sapiens 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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