Detailed information for compound 1653881

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 403.449 | Formula: C24H22FN3O2
  • H donors: 2 H acceptors: 3 LogP: 5.13 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1ccc(cc1)CN(C(=O)c1cc2c(n[nH]c2cc1O)Cc1cccc(c1)C)C
  • InChi: 1S/C24H22FN3O2/c1-15-4-3-5-17(10-15)11-21-19-12-20(23(29)13-22(19)27-26-21)24(30)28(2)14-16-6-8-18(25)9-7-16/h3-10,12-13,29H,11,14H2,1-2H3,(H,26,27)
  • InChiKey: SCNCSAGXTCHOKM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens heat shock protein 90kDa alpha (cytosolic), class B member 1 Starlite/ChEMBL 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 heat shock protein 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
Giardia lamblia Heat shock protein HSP 90-alpha 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 brucei heat shock protein, 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
Entamoeba histolytica heat shock protein 90, 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
Theileria parva heat shock protein 90 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
Echinococcus granulosus heat shock protein 90 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
Cryptosporidium hominis heat shock protein 83 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
Trypanosoma brucei gambiense Heat shock protein 83, putative 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
Leishmania mexicana 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
Leishmania major heat shock protein 83-1 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
Loa Loa (eye worm) heat shock protein 90 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
Toxoplasma gondii 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 japonicum ko:K04079 molecular chaperone HtpG, putative 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
Candida albicans heat shock 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
Cryptosporidium parvum Hsp90 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
Leishmania infantum 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
Echinococcus multilocularis heat shock protein Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus granulosus endoplasmin Get druggable targets OG5_126623 All targets in OG5_126623
Echinococcus multilocularis endoplasmin 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
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
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Plasmodium knowlesi endoplasmin, putative 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
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
Leishmania major heat shock protein 83-1 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 heat shock protein 90, 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
Leishmania major heat shock protein 83-1 Get druggable targets OG5_126623 All targets in OG5_126623
Schistosoma mansoni endoplasmin 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
Trypanosoma brucei heat shock protein, putative 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
Trichomonas vaginalis heat shock protein, putative 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
Neospora caninum HSP90, related 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
Treponema pallidum heat shock protein 90 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
Trypanosoma cruzi heat shock protein 85, 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
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
Trypanosoma brucei 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 japonicum Heat shock protein 83, 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
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
Trypanosoma brucei Heat shock protein 83, putative 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
Schistosoma mansoni endoplasmin 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
Trypanosoma cruzi heat shock protein 90, putative 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
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
Neospora caninum HSP90-like protein, related 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
Trypanosoma brucei heat shock protein, 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
Toxoplasma gondii heat shock protein HSP90 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
Candida albicans hypothetical protein 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 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
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
Plasmodium knowlesi 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_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
Plasmodium vivax endoplasmin, putative 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
Trypanosoma congolense 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
Leishmania braziliensis heat shock protein 83-1 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
Plasmodium yoelii heat shock protein 90 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
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 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 major heat shock protein 83-1 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
Giardia lamblia Heat shock protein HSP 90-alpha Get druggable targets OG5_126623 All targets in OG5_126623
Giardia lamblia Grp94/Hsp90 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
Plasmodium yoelii heat shock 90 kDa protein homolog 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
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
Babesia bovis hsp90 protein Get druggable targets OG5_126623 All targets in OG5_126623
Mycobacterium ulcerans heat shock protein 90 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
Plasmodium falciparum heat shock protein 90, putative heat shock protein 90kDa alpha (cytosolic), class B member 1 724 aa 725 aa 35.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus granulosus mesoderm induction early response protein 1 0.0025 0.0105 0.0136
Echinococcus multilocularis endoplasmin 0.0031 0.0174 0.0226
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Toxoplasma gondii heat shock protein 90, putative 0.0039 0.0265 1
Echinococcus granulosus heat shock protein 90 0.0039 0.0265 0.0342
Echinococcus multilocularis SANT, DNA binding 0.0025 0.0105 0.0137
Loa Loa (eye worm) hypothetical protein 0.0865 0.9711 0.9711
Schistosoma mansoni rest corepressor (corest) protein 0.0025 0.0105 0.1623
Giardia lamblia Heat shock protein HSP 90-alpha 0.0039 0.0265 1
Trypanosoma brucei Heat shock protein 83, putative 0.0039 0.0265 1
Trichomonas vaginalis heat shock protein, putative 0.0031 0.0174 0.655
Trypanosoma brucei heat shock protein, putative 0.0039 0.0265 1
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Echinococcus granulosus REST corepressor 3 0.0025 0.0105 0.0136
Schistosoma mansoni zinc finger protein 0.0025 0.0105 0.1625
Echinococcus multilocularis conserved hypothetical protein 0.0686 0.7667 1
Plasmodium vivax hypothetical protein 0.0025 0.0105 0.3966
Trypanosoma cruzi heat shock protein 85, putative 0.0039 0.0265 1
Trypanosoma brucei heat shock protein, putative 0.0039 0.0265 1
Loa Loa (eye worm) heat shock protein 90 0.0039 0.0265 0.0265
Loa Loa (eye worm) hypothetical protein 0.0025 0.0105 0.0105
Trypanosoma brucei heat shock protein 90, putative 0.0039 0.0265 1
Trypanosoma brucei heat shock protein, putative 0.0039 0.0265 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.0718 0.0718
Echinococcus granulosus zinc finger protein 541 0.0025 0.0105 0.0136
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Trichomonas vaginalis heat shock protein, putative 0.0024 0.0091 0.345
Treponema pallidum heat shock protein 90 0.0031 0.0174 0.5
Echinococcus granulosus hypothetical protein 0.0693 0.7748 1
Brugia malayi heat shock protein 90 0.0039 0.0265 0.0273
Brugia malayi Myb-like DNA-binding domain containing protein 0.0865 0.9711 1
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Brugia malayi SWIRM domain containing protein 0.0079 0.0718 0.0739
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Mycobacterium tuberculosis Probable chaperone protein HtpG (heat shock protein) (HSP90 family protein) (high temperature protein G) 0.0031 0.0174 0.5
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Schistosoma mansoni metastasis-associated protein 1 (mta1) 0.0025 0.0105 0.1623
Echinococcus granulosus heat shock protein heat shock protein 90 alpha 0.0031 0.0174 0.0224
Entamoeba histolytica heat shock protein 90, putative 0.0039 0.0265 1
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Echinococcus multilocularis metastasis associated protein 1 (mta1) 0.0025 0.0105 0.0137
Onchocerca volvulus 0.0079 0.0718 0.0718
Loa Loa (eye worm) hypothetical protein 0.0025 0.0105 0.0105
Toxoplasma gondii heat shock protein HSP90 0.0039 0.0265 1
Loa Loa (eye worm) GATA zinc finger family protein 0.0025 0.0105 0.0105
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Schistosoma mansoni endoplasmin 0.0039 0.0265 0.4092
Brugia malayi ELM2 domain containing protein 0.0025 0.0105 0.0108
Leishmania major lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative 0.0031 0.0174 0.655
Echinococcus granulosus SANT DNA binding 0.0025 0.0105 0.0136
Schistosoma mansoni endoplasmin 0.0039 0.0265 0.4092
Loa Loa (eye worm) endoplasmin 0.0039 0.0265 0.0265
Echinococcus granulosus lysine specific histone demethylase 1A 0.0073 0.0648 0.0836
Trypanosoma cruzi heat shock protein 85, putative 0.0031 0.0174 0.655
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Trypanosoma brucei heat shock protein, putative 0.0039 0.0265 1
Schistosoma mansoni heat shock protein 0.0039 0.0265 0.4092
Brugia malayi ELM2 domain containing protein 0.0025 0.0105 0.0108
Trichomonas vaginalis heat shock protein, putative 0.0031 0.0174 0.655
Plasmodium falciparum heat shock protein 90 0.0039 0.0265 1
Trypanosoma cruzi heat shock protein 90, putative 0.0031 0.0174 0.655
Trypanosoma brucei heat shock protein, putative 0.0039 0.0265 1
Echinococcus multilocularis heat shock protein 90 0.0039 0.0265 0.0346
Plasmodium vivax heat shock protein 86, putative 0.0039 0.0265 1
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Echinococcus multilocularis metastasis associated protein MTA1 0.0025 0.0105 0.0137
Trypanosoma brucei heat shock protein, putative 0.0039 0.0265 1
Trypanosoma brucei heat shock protein, putative 0.0039 0.0265 1
Onchocerca volvulus CoRest homolog 0.089 1 1
Loa Loa (eye worm) hypothetical protein 0.0025 0.0105 0.0105
Trypanosoma brucei heat shock protein 90, putative 0.0039 0.0265 1
Schistosoma mansoni heat shock protein 0.0039 0.0265 0.4092
Trypanosoma cruzi Heat shock protein 83, putative 0.0039 0.0265 1
Echinococcus granulosus metastasis associated protein MTA1 0.0025 0.0105 0.0136
Trypanosoma cruzi heat shock protein 85, putative 0.0039 0.0265 1
Schistosoma mansoni Lysine-specific histone demethylase 1 0.0073 0.0648 1
Plasmodium vivax endoplasmin, putative 0.0039 0.0265 1
Trypanosoma cruzi heat shock protein 90, putative 0.0039 0.0265 1
Brugia malayi Endoplasmin precursor 0.0039 0.0265 0.0273
Trypanosoma cruzi heat shock protein 90, putative 0.0023 0.0081 0.3058
Echinococcus multilocularis rest corepressor (corest) protein 0.0025 0.0105 0.0137
Echinococcus multilocularis heat shock protein 0.0039 0.0265 0.0346
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Echinococcus multilocularis lysine specific histone demethylase 1A 0.0073 0.0648 0.0845
Mycobacterium leprae PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G) 0.0031 0.0174 0.5
Brugia malayi Serotonin receptor 0.0465 0.5131 0.5284
Trichomonas vaginalis endoplasmin, putative 0.0024 0.0091 0.345
Echinococcus granulosus heat shock protein 0.0039 0.0265 0.0342
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Loa Loa (eye worm) hypothetical protein 0.0073 0.0648 0.0648
Schistosoma mansoni metastasis-associated protein 1 (mta1) 0.0025 0.0105 0.1623
Echinococcus multilocularis mesoderm induction early response protein 1 0.0025 0.0105 0.0137
Echinococcus granulosus heat shock protein 90 0.0031 0.0174 0.0224
Echinococcus granulosus metastasis associated protein 1 mta1 0.0025 0.0105 0.0136
Onchocerca volvulus Mesoderm induction early response 1 related homolog 0.0025 0.0105 0.0105
Trypanosoma brucei heat shock protein, putative 0.0039 0.0265 1
Brugia malayi Myb-like DNA-binding domain containing protein 0.0025 0.0105 0.0108
Loa Loa (eye worm) hypothetical protein 0.0073 0.0648 0.0648
Plasmodium falciparum endoplasmin, putative 0.0024 0.0091 0.345
Entamoeba histolytica heat shock protein 90, putative 0.0039 0.0265 1
Echinococcus multilocularis heat shock protein 90 0.0031 0.0174 0.0226
Wolbachia endosymbiont of Brugia malayi heat shock protein 90 0.0031 0.0174 0.5
Trichomonas vaginalis heat shock protein, putative 0.0031 0.0174 0.655
Leishmania major heat shock protein 83-1 0.0039 0.0265 1
Echinococcus multilocularis zinc finger protein 541 0.0025 0.0105 0.0137
Trypanosoma cruzi heat shock protein 85, putative 0.0039 0.0265 1
Mycobacterium ulcerans heat shock protein 90 0.0031 0.0174 0.5
Echinococcus granulosus endoplasmin 0.0031 0.0174 0.0224
Trichomonas vaginalis heat shock protein, putative 0.0039 0.0265 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.0055 0.0055
Brugia malayi amine oxidase, flavin-containing family protein 0.0021 0.0055 0.0057
Schistosoma mansoni rest corepressor (corest) protein 0.0025 0.0105 0.1623

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.58 uM Displacement of [3H]17AAG from human recombinant Hsp90 after 30 mins by beta scintillation counting ChEMBL. 22632933
IC50 (functional) = 0.59 uM Antiproliferative activity against human A2780 cells after 72 hrs by alamar blue assay ChEMBL. 22632933

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 22632933

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

1 literature reference was collected for this gene.

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