Detailed information for compound 1186637

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 546.743 | Formula: C33H46N4O3
  • H donors: 1 H acceptors: 4 LogP: 4.64 Rotable bonds: 13
    Rule of 5 violations (Lipinski): 2
  • SMILES: O=C(CC1CC(=C(N(C1=O)Cc1ccc(cc1)C(C)(C)C)C)C(=O)N(C(C)C)C(C)C)NCCc1ccccn1
  • InChi: 1S/C33H46N4O3/c1-22(2)37(23(3)4)32(40)29-19-26(20-30(38)35-18-16-28-11-9-10-17-34-28)31(39)36(24(29)5)21-25-12-14-27(15-13-25)33(6,7)8/h9-15,17,22-23,26H,16,18-21H2,1-8H3,(H,35,38)
  • InChiKey: DKJKYPASTOOWKX-UHFFFAOYSA-N  

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 70kDa protein 5 (glucose-regulated protein, 78kDa) Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Babesia bovis heat shock protein 70 precursor, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein 70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma congolense heat shock 70 kDa protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Onchocerca volvulus Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein 4 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania mexicana heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Neospora caninum Heat shock protein 70 (Precursor), related Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein 70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 71 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein 70 (HSP70)-4, putative Get druggable targets OG5_126588 All targets in OG5_126588
Schistosoma mansoni heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium falciparum heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein 70kD, putative Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium knowlesi heat shock protein 70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma brucei heat shock 70 kDa protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Candida albicans similar to S. cerevisiae KAR2 (YJL034W) HSP70/ BiP family ATPase and chaperone involved in translocation of nascent polypeptides Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein70, hsp70A2, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus Heat shock 70 kDa protein 4 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 related Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Candida albicans heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Cryptosporidium hominis heat shock protein Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania infantum heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma congolense luminal binding protein 1 (BiP), putative Get druggable targets OG5_126588 All targets in OG5_126588
Schistosoma mansoni heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma cruzi glucose-regulated protein 78, putative Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania infantum heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Neospora caninum Heat shock protein 70, related Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein70, hsp70A2, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus Heat shock 70 kDa protein 4 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania braziliensis heat shock protein 70-related protein Get druggable targets OG5_126588 All targets in OG5_126588
Babesia bovis dnaK protein Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis microsomal stress 70 protein ATPase core precursor, putative Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania infantum heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania mexicana heat shock protein 70-related protein Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania braziliensis glucose-regulated protein 78, putative Get druggable targets OG5_126588 All targets in OG5_126588
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Echinococcus granulosus heat shock protein 71 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 related Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium yoelii heat shock protein Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania mexicana heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 related Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein 4 Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus 3'partial|5'partial|heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70b Get druggable targets OG5_126588 All targets in OG5_126588
Schistosoma japonicum hypothetical protein Get druggable targets OG5_126588 All targets in OG5_126588
Brugia malayi heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein 70 (HSP70)-4, putative Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein70, hsp70A2, putative Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Candida albicans heat shock protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock protein 70 (HSP70) Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania donovani heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70b Get druggable targets OG5_126588 All targets in OG5_126588
Giardia lamblia Bip Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock 70 kDa protein 1A:1B Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein70, hsp70A2, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma brucei gambiense glucose-regulated protein 78, putative,luminal binding protein 1 (BiP), putative Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania infantum heat shock protein 70-related protein Get druggable targets OG5_126588 All targets in OG5_126588
Schistosoma japonicum ko:K09490 heat shock 70kDa protein 5, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Candida albicans HSP70 Get druggable targets OG5_126588 All targets in OG5_126588
Cryptosporidium parvum heat shock protein, Hsp70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma brucei gambiense heat shock 70 kDa protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium knowlesi heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania mexicana glucose-regulated protein 78, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein 4 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Schistosoma mansoni heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma congolense luminal binding protein 1 (BiP), putative Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein 70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Get druggable targets OG5_126588 All targets in OG5_126588
Giardia lamblia Cytosolic HSP70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock kda protein Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania donovani heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus Heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock kda protein Get druggable targets OG5_126588 All targets in OG5_126588
Candida albicans heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania major heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein kDa heat shock kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica 70 kDa heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 71 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus Heat Shock protein family member hsp 3 Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein 70kD, putative Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma congolense heat shock 70 kDa protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Theileria parva heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus Heat shock 70 kDa protein 4 Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium berghei heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania braziliensis heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Cryptosporidium parvum heat shock 70 (HSP70) protein Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein 70 family Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Loa Loa (eye worm) heat shock 70kDa protein 5 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica hypothetical protein Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania major heat shock protein 70-related protein Get druggable targets OG5_126588 All targets in OG5_126588
Toxoplasma gondii heat shock protein HSP70 Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania donovani luminal binding protein 1 (BiP), putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus Heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma brucei heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Candida albicans Cytoplasmic chaperone Get druggable targets OG5_126588 All targets in OG5_126588
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Echinococcus multilocularis heat shock protein kDa heat shock kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Schistosoma japonicum similar to Heat shock 70 kDa protein homolog, putative Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium berghei heat shock protein 70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein 70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma cruzi heat shock protein 70 (hsp70), putative Get druggable targets OG5_126588 All targets in OG5_126588
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Cryptosporidium hominis heat shock protein 70 precursor Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania major glucose-regulated protein 78, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock 70 kDa protein 1 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania donovani heat shock protein 70-related protein Get druggable targets OG5_126588 All targets in OG5_126588
Entamoeba histolytica heat shock protein 70 family Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania infantum glucose-regulated protein 78, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein kDa Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium vivax heat shock protein 70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma brucei luminal binding protein 1 (BiP), putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 related Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium falciparum heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma congolense heat shock 70 kDa protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Candida albicans Cytoplasmic chaperone Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania major heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Toxoplasma gondii chaperonin protein BiP Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus Heat shock 70 kDa protein 4 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium falciparum heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 71 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma cruzi heat shock protein 70 (hsp70), putative Get druggable targets OG5_126588 All targets in OG5_126588
Theileria parva heat shock protein 70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock 70 kda protein 1a Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat Shock protein family member (hsp 3) Get druggable targets OG5_126588 All targets in OG5_126588
Schistosoma japonicum similar to Heat shock 70 kDa protein cognate 4, putative Get druggable targets OG5_126588 All targets in OG5_126588
Brugia malayi heat shock 70 kDa protein C precursor Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium vivax heat shock 70 kDa protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma congolense heat shock 70 kDa protein, putative Get druggable targets OG5_126588 All targets in OG5_126588
Plasmodium yoelii heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma brucei gambiense glucose-regulated protein 78, putative,luminal binding protein 1 (BiP), putative Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma brucei luminal binding protein 1 (BiP), putative Get druggable targets OG5_126588 All targets in OG5_126588
Candida albicans HSP70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Trypanosoma brucei heat shock protein 70 (hsp70), putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein 70 Get druggable targets OG5_126588 All targets in OG5_126588
Leishmania infantum heat-shock protein hsp70, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus multilocularis Heat shock 70 kDa protein Get druggable targets OG5_126588 All targets in OG5_126588
Trichomonas vaginalis heat shock protein 70 (HSP70)-4, putative Get druggable targets OG5_126588 All targets in OG5_126588
Echinococcus granulosus heat shock protein Get druggable targets OG5_126588 All targets in OG5_126588

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Plasmodium falciparum heat shock protein 70 heat shock 70kDa protein 5 (glucose-regulated protein, 78kDa) 654 aa 613 aa 51.9 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Schistosoma mansoni lipoxygenase 0.0119 0.0628 0.0628
Loa Loa (eye worm) hypothetical protein 0.0229 0.1327 0.1327
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0073 0.0336 0.0206
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0073 0.0336 0.0206
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0073 0.0336 0.0206
Leishmania major ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative 0.0229 0.1327 0.3306
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0073 0.0336 0.0206
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0073 0.0336 0.0206
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0073 0.0336 0.0206
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0073 0.0336 0.0233
Echinococcus granulosus cytochrome P450 2K1 0.0073 0.0336 0.0336
Brugia malayi Cytochrome P450 family protein 0.0127 0.0681 0.0681
Echinococcus multilocularis 0.0073 0.0336 0.0336
Schistosoma mansoni ubiquitin-specific peptidase 2 (C19 family) 0.0229 0.1327 0.1327
Trypanosoma cruzi cytochrome P450, putative 0.0127 0.0681 0.1519
Mycobacterium leprae putative cytochrome p450 0.0073 0.0336 0.0233
Echinococcus multilocularis ubiquitin carboxyl terminal hydrolase 8 0.0229 0.1327 0.1327
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0073 0.0336 0.0233
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0073 0.0336 0.0206
Brugia malayi MH2 domain containing protein 0.0144 0.0788 0.0788
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0041 0.0133 0.5
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0073 0.0336 0.0206
Leishmania major cytochrome p450-like protein 0.0073 0.0336 0.0563
Brugia malayi Cytochrome P450 family protein 0.0127 0.0681 0.0681
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0461 0.2797 0.2797
Leishmania major cytochrome p450-like protein 0.0073 0.0336 0.0563
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0073 0.0336 0.0233
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0073 0.0336 0.0206
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0073 0.0336 0.0563
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0229 0.1327 1
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0611 0.3746 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.0788 0.0788
Schistosoma mansoni cytochrome P450 0.0073 0.0336 0.0336
Schistosoma mansoni ubiquitin-specific peptidase 8 (C19 family) 0.0229 0.1327 0.1327
Trypanosoma brucei Lanosterol 14-alpha demethylase 0.0073 0.0336 0.0563
Trypanosoma brucei cytochrome P450, putative 0.0127 0.0681 0.1519
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0073 0.0336 0.0206
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0073 0.0336 0.0233
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0073 0.0336 0.0206
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0073 0.0336 0.0233
Schistosoma mansoni lipoxygenase 0.0083 0.0401 0.0401
Mycobacterium leprae Conserved hypothetical protein 0.0073 0.0336 0.0233
Trypanosoma brucei ubiquitin carboxyl-terminal hydrolase, putative 0.0229 0.1327 0.3306
Echinococcus multilocularis ubiquitin specific protease 41 0.0229 0.1327 0.1327
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0073 0.0336 0.0233
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0073 0.0336 0.0233
Trypanosoma cruzi cytochrome p450-like protein, putative 0.0073 0.0336 0.0563
Brugia malayi Cytochrome P450 family protein 0.015 0.0824 0.0824
Loa Loa (eye worm) hypothetical protein 0.0054 0.0219 0.0219
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0073 0.0336 0.0233
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0073 0.0336 0.0206
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0073 0.0336 0.0233
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0611 0.3746 1
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0073 0.0336 0.0233
Loa Loa (eye worm) cytochrome P450 family protein 0.0127 0.0681 0.0681
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0073 0.0336 0.0206
Echinococcus granulosus inositol monophosphatase 1 0.0041 0.0133 0.0133
Trichomonas vaginalis Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase 0.0229 0.1327 1
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0073 0.0336 0.0563
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0127 0.0681 0.0556
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0119 0.0628 0.0628
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0073 0.0336 0.0206
Echinococcus multilocularis inositol monophosphatase 1 0.0041 0.0133 0.0133
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0073 0.0336 0.0206
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0073 0.0336 0.0233
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0073 0.0336 0.0233
Loa Loa (eye worm) CYP4Cod1 0.0127 0.0681 0.0681
Loa Loa (eye worm) inositol-1 0.0041 0.0133 0.0133
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0119 0.0628 0.0628
Echinococcus granulosus ubiquitin specific protease 41 0.0229 0.1327 0.1327
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0229 0.1327 0.3306
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0073 0.0336 0.0233
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0073 0.0336 0.0233
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0611 0.3746 1
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0073 0.0336 0.0206
Loa Loa (eye worm) cytochrome P450 0.0073 0.0336 0.0336
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0611 0.3746 1
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0611 0.3746 1
Schistosoma mansoni hypothetical protein 0.0073 0.0336 0.0336
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0073 0.0336 0.0206
Toxoplasma gondii cytochrome p450 superfamily protein 0.0073 0.0336 0.0563
Schistosoma mansoni inositol monophosphatase 0.0041 0.0133 0.0133
Entamoeba histolytica ubiquitin carboxyl-terminal hydrolase domain containing protein 0.0229 0.1327 1
Brugia malayi cytochrome P450 0.0073 0.0336 0.0336
Echinococcus multilocularis Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 0.0229 0.1327 0.1327
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0073 0.0336 0.0233
Echinococcus granulosus ubiquitin carboxyl terminal hydrolase 8 0.0229 0.1327 0.1327
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0073 0.0336 0.0233
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0073 0.0336 0.0233
Trypanosoma cruzi cytochrome P450, putative 0.0127 0.0681 0.1519
Brugia malayi follicle stimulating hormone receptor 0.0461 0.2797 0.2797
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0073 0.0336 0.0206
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0073 0.0336 0.0206
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0611 0.3746 1
Trypanosoma cruzi ubiquitin carboxyl-terminal hydrolase, putative 0.0229 0.1327 0.3306
Trypanosoma cruzi Lanosterol 14-alpha demethylase 0.0073 0.0336 0.0563
Schistosoma mansoni inositol monophosphatase 0.0041 0.0133 0.0133
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.0788 0.0788
Leishmania major cytochrome p450-like protein 0.0127 0.0681 0.1519
Loa Loa (eye worm) cytochrome P450 family protein 0.015 0.0824 0.0824
Brugia malayi Ubiquitin carboxyl-terminal hydrolase family protein 0.0229 0.1327 0.1327
Echinococcus granulosus Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 0.0229 0.1327 0.1327
Loa Loa (eye worm) cytochrome P450 family protein 0.0127 0.0681 0.0681
Giardia lamblia Ubiquitin carboxyl-terminal hydrolase 4 0.0229 0.1327 0.5
Brugia malayi Inositol-1 0.0041 0.0133 0.0133
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0073 0.0336 0.0233
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0073 0.0336 0.0233
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0073 0.0336 0.0233
Brugia malayi Cytochrome P450 family protein 0.0073 0.0336 0.0336
Trichomonas vaginalis conserved hypothetical protein 0.0229 0.1327 1
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0073 0.0336 0.0206

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 8.9125 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 12.5893 uM PUBCHEM_BIOASSAY: qHTS for Inducers of the Endoplasmic Reticulum Stress Response (ERSR) in Human Glioma: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 22.3872 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
Potency (functional) 29.0929 uM PubChem BioAssay. qHTS for Inhibitors of TGF-b: CCL64 Cells Orthogonal Assay for Cherry Picks. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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