Detailed information for compound 508408

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 941.156 | Formula: C54H72N2O12
  • H donors: 6 H acceptors: 9 LogP: 1.38 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 3
  • SMILES: OC[C@]1(C)C[C@H]([C@]2(O1)O[C@@H]1[C@@]([C@@H]2C)(O)[C@@]2(C(=C1)[C@@H]1CC[C@@H]3[C@]([C@H]1C[C@H]2O)(C)Cc1c(C3)nc2c(n1)C[C@H]1[C@@](C2)(C)C2=CC(=O)[C@]34[C@@]5([C@@]2(CC1)O)O[C@H]5C[C@@H]4[C@H]([C@]1(OC3)OC(C[C@H]1O)(C)C)C)C)O
  • InChi: 1S/C54H72N2O12/c1-25-30-16-43-54(66-43)49(30,24-64-52(25)40(60)21-44(3,4)67-52)39(59)18-37-47(7)20-36-34(14-28(47)11-12-50(37,54)62)55-35-19-46(6)27(13-33(35)56-36)9-10-29-31(46)15-38(58)48(8)32(29)17-42-51(48,63)26(2)53(65-42)41(61)22-45(5,23-57)68-53/h17-18,25-31,38,40-43,57-58,60-63H,9-16,19-24H2,1-8H3/t25-,26+,27+,28+,29-,30-,31+,38-,40-,41-,42+,43+,45+,46+,47+,48-,49+,50+,51-,52+,53+,54+/m1/s1
  • InChiKey: HDXIKQGPMMNJIT-OXWLBRLASA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0036 0.0432 0.1206
Brugia malayi Steroid receptor seven-up type 2 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0036 0.0432 0.0432
Echinococcus multilocularis nuclear receptor nhr 48 0.0017 0.0032 0.0043
Brugia malayi conserved hypotetical protein 0.0017 0.0032 0.0032
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0742 0.2069
Loa Loa (eye worm) hypothetical protein 0.0019 0.0075 0.0075
Schistosoma mansoni tar DNA-binding protein 0.0133 0.2441 0.6809
Echinococcus granulosus survival motor neuron protein 1 0.0255 0.4998 0.6864
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0742 0.1019
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0222 1
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0019 0.0075 0.0075
Brugia malayi nuclear receptor NHR-88 0.0017 0.0032 0.0032
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0019 0.0075 0.0102
Echinococcus multilocularis tumor protein p63 0.0364 0.7282 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0036 0.0432 0.0432
Schistosoma mansoni ap endonuclease 0.0018 0.0056 0.0157
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Brugia malayi Protein kinase domain containing protein 0.01 0.1758 0.1758
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0018 0.0056 0.0321
Brugia malayi ecdysteroid receptor 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0187 0.3586 0.3586
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0036 0.0432 0.0432
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0018 0.0056 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0036 0.0432 0.0432
Schistosoma mansoni survival motor neuron protein 0.0052 0.076 0.2119
Brugia malayi nuclear receptor RXR 0.0019 0.0075 0.0075
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Mycobacterium ulcerans D-amino acid oxidase Aao 0.0187 0.3586 1
Brugia malayi hypothetical protein 0.0255 0.4998 0.4998
Echinococcus granulosus nuclear receptor nhr 48 0.0017 0.0032 0.0043
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0017 0.0032 0.0043
Loa Loa (eye worm) RNA binding protein 0.0133 0.2441 0.2441
Schistosoma mansoni serine/threonine protein kinase 0.01 0.1758 0.4903
Loa Loa (eye worm) hypothetical protein 0.0053 0.0787 0.0787
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0018 0.0056 0.0157
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0017 0.0032 0.0032
Echinococcus multilocularis FTZ F1 alpha 0.0036 0.0432 0.0594
Brugia malayi Nuclear hormone receptor E75 0.0017 0.0032 0.0032
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0742 0.1019
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0051 0.0742 0.1019
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0036 0.0432 0.0432
Brugia malayi nuclear receptor NHR-88 0.0036 0.0432 0.0432
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0036 0.0432 0.0594
Treponema pallidum exodeoxyribonuclease (exoA) 0.0018 0.0056 0.5
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0036 0.0432 0.0432
Onchocerca volvulus 0.0052 0.076 0.965
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0036 0.0432 0.1206
Loa Loa (eye worm) glutamate receptor 0.0018 0.006 0.006
Brugia malayi nuclear hormone receptor family member odr-7 0.0017 0.0032 0.0032
Loa Loa (eye worm) glutamate receptor 0.0047 0.0656 0.0656
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0222 0.1262
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0017 0.0032 0.0032
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0019 0.0075 0.0208
Brugia malayi Nuclear hormone receptor-like 1 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0019 0.0075 0.0075
Mycobacterium leprae PROBABLE D-AMINO ACID OXIDASE AAO 0.0187 0.3586 1
Loa Loa (eye worm) hypothetical protein 0.0099 0.1747 0.1747
Loa Loa (eye worm) MH2 domain-containing protein 0.0133 0.2462 0.2462
Schistosoma mansoni tar DNA-binding protein 0.0133 0.2441 0.6809
Brugia malayi hypothetical protein 0.0017 0.0032 0.0032
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0036 0.0432 0.0432
Schistosoma mansoni coup transcription factor 0.0036 0.0432 0.1206
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0099 0.1747 0.1747
Schistosoma mansoni steroid hormone receptor ad4bp 0.0036 0.0432 0.1206
Echinococcus granulosus thyroid hormone receptor alpha 0.0017 0.0032 0.0043
Onchocerca volvulus Protein ultraspiracle homolog 0.0036 0.0432 0.5489
Schistosoma mansoni d-amino acid oxidase 0.0187 0.3586 1
Brugia malayi metabotropic glutamate receptor type 2 0.0023 0.0153 0.0153
Brugia malayi tailless protein 0.0017 0.0032 0.0032
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0018 0.0056 0.0056
Brugia malayi ecdysone receptor 0.0017 0.0032 0.0032
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0036 0.0432 0.0432
Schistosoma mansoni nuclear receptor 0.0017 0.0032 0.0088
Schistosoma mansoni nuclear hormone receptor 0.0017 0.0032 0.0088
Loa Loa (eye worm) hypothetical protein 0.0058 0.0883 0.0883
Loa Loa (eye worm) hypothetical protein 0.0019 0.0075 0.0075
Toxoplasma gondii exonuclease III APE 0.0018 0.0056 0.2542
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0017 0.0032 0.0088
Onchocerca volvulus 0.0036 0.0432 0.5489
Brugia malayi nuclear hormone receptor 0.0017 0.0032 0.0032
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0017 0.0032 0.0043
Brugia malayi hypothetical protein 0.0017 0.0028 0.0028
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0051 0.0742 0.0742
Echinococcus granulosus FTZ F1 alpha 0.0036 0.0432 0.0594
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0036 0.0432 0.0432
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0056 0.2542
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0742 0.2069
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0018 0.0056 0.2542
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Brugia malayi exodeoxyribonuclease III family protein 0.0018 0.0056 0.0056
Brugia malayi Nuclear hormone receptor-like 1 0.0019 0.0075 0.0075
Schistosoma mansoni RAR-like nuclear receptor 0.0036 0.0432 0.1206
Loa Loa (eye worm) hypothetical protein 0.0255 0.4998 0.4998
Entamoeba histolytica hypothetical protein 0.01 0.1758 1
Loa Loa (eye worm) nuclear receptor NHR-67 0.0017 0.0032 0.0032
Schistosoma mansoni retinoic acid receptor RXR 0.0036 0.0432 0.1206
Schistosoma mansoni nuclear receptor 0.0017 0.0032 0.0088
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0036 0.0432 0.0432
Brugia malayi RNA binding protein 0.0133 0.2441 0.2441
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0017 0.0032 0.0043
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0036 0.0432 0.0594
Echinococcus granulosus tar DNA binding protein 0.0133 0.2441 0.3353
Schistosoma mansoni zinc finger protein 0.0017 0.0032 0.0088
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0018 0.0056 0.0321
Loa Loa (eye worm) hypothetical protein 0.0036 0.0432 0.0432
Brugia malayi photoreceptor-specific nuclear receptor 0.0036 0.0432 0.0432
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0019 0.0075 0.0102
Trypanosoma brucei CMGC/DYRK protein kinase, putative 0.01 0.1758 1
Brugia malayi Nuclear hormone receptor E75 0.0017 0.0032 0.0032
Brugia malayi Metabotropic glutamate receptor precursor. 0.0047 0.0656 0.0656
Echinococcus granulosus Nuclear hormone receptor HR96 0.0017 0.0032 0.0043
Brugia malayi hypothetical protein 0.0017 0.0032 0.0032
Leishmania major hypothetical protein, conserved 0.0026 0.0222 0.1262
Echinococcus granulosus ecdysone induced protein 78C 0.0036 0.0432 0.0594
Schistosoma mansoni tar DNA-binding protein 0.0133 0.2441 0.6809
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0018 0.0056 0.0173
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0018 0.0056 0.5
Schistosoma mansoni nuclear receptor nhr-48 0.0017 0.0032 0.0088
Echinococcus multilocularis tar DNA binding protein 0.0133 0.2441 0.3353
Schistosoma mansoni tar DNA-binding protein 0.0133 0.2441 0.6809
Entamoeba histolytica protein kinase, putative 0.01 0.1758 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0036 0.0432 0.0594
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0018 0.0056 0.0077
Brugia malayi hypothetical protein 0.0026 0.0222 0.0222
Echinococcus granulosus Nuclear hormone receptor HR96 0.0017 0.0032 0.0043
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0036 0.0432 0.1206
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0019 0.0075 0.0208
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0222 1
Onchocerca volvulus 0.0053 0.0787 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0036 0.0432 0.0432
Chlamydia trachomatis D-amino acid dehydrogenase 0.0016 0 0.5
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0019 0.0075 0.0075
Schistosoma mansoni ap endonuclease 0.0018 0.0056 0.0157
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0036 0.0432 0.0594
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0036 0.0432 0.0594
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0036 0.0432 0.0432
Brugia malayi steroid hormone receptor 0.0036 0.0432 0.0432
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0019 0.0075 0.0075
Schistosoma mansoni hypothetical protein 0.0052 0.076 0.2119
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0017 0.0032 0.0043
Brugia malayi metabotropic glutamate receptor subtype 5a (mGluR5a), putative 0.0043 0.0563 0.0563
Echinococcus granulosus metabotropic glutamate receptor 5 0.0058 0.0883 0.1212
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.01 0.1758 1
Schistosoma mansoni nuclear hormone receptor 0.0036 0.0432 0.1206
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0017 0.0032 0.0402
Schistosoma mansoni tar DNA-binding protein 0.0133 0.2441 0.6809
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0017 0.0032 0.0043
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0036 0.0432 0.0594
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0018 0.0056 0.0321
Brugia malayi MH2 domain containing protein 0.0133 0.2462 0.2462
Onchocerca volvulus 0.0017 0.0032 0.0402
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0222 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0051 0.0742 0.2069
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0036 0.0432 0.1206
Loa Loa (eye worm) transcription factor SMAD2 0.0133 0.2462 0.2462
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0017 0.0032 0.0088
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0058 0.0883 0.1212
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0036 0.0432 0.0594
Loa Loa (eye worm) nuclear hormone receptor 0.0017 0.0032 0.0032
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0036 0.0432 0.1206
Brugia malayi RNA recognition motif domain containing protein 0.0133 0.2441 0.2441
Onchocerca volvulus Bile acid receptor homolog 0.0036 0.0432 0.5489
Loa Loa (eye worm) hypothetical protein 0.0036 0.0432 0.0432
Brugia malayi TAR-binding protein 0.0133 0.2441 0.2441
Schistosoma mansoni thyroid hormone receptor 0.0036 0.0432 0.1206
Brugia malayi nuclear hormone receptor 0.0036 0.0432 0.0432
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0018 0.0056 0.0321
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0039 0.0496 0.0682
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative 0.01 0.1758 1
Loa Loa (eye worm) CMGC/DYRK/DYRK1 protein kinase 0.01 0.1758 0.1758
Brugia malayi nuclear hormone receptor family member nhr-6 0.0017 0.0032 0.0032
Loa Loa (eye worm) TAR-binding protein 0.0133 0.2441 0.2441
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0222 0.1262
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0494 1 1
Echinococcus granulosus dual specificity 0.01 0.1758 0.2414
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0017 0.0032 0.0402
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0017 0.0032 0.0043
Entamoeba histolytica protein kinase domain containing protein 0.01 0.1758 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0018 0.0056 0.0321
Echinococcus granulosus metabotropic glutamate receptor 2 0.0039 0.0496 0.0682
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0056 0.5
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0036 0.0432 0.0432
Loa Loa (eye worm) hypothetical protein 0.0036 0.0432 0.0432
Echinococcus multilocularis dual specificity 0.01 0.1758 0.2414
Mycobacterium tuberculosis Probable D-amino acid oxidase Aao 0.0172 0.3259 1
Echinococcus granulosus tumor protein p63 0.0364 0.7282 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0036 0.0432 0.0594
Echinococcus multilocularis ecdysone induced protein 78C 0.0036 0.0432 0.0594
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Schistosoma mansoni cellular tumor antigen P53 0.0053 0.0787 0.2196
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0036 0.0432 0.0432
Brugia malayi orphan nuclear receptor NR2E1 0.0017 0.0032 0.0032
Brugia malayi nuclear receptor RXR 0.0017 0.0032 0.0032
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0036 0.0432 0.0432
Schistosoma mansoni metabotropic glutamate receptor 0.0039 0.0496 0.1385
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0036 0.0432 0.0432
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0051 0.0742 0.1019
Loa Loa (eye worm) DR-78 0.0017 0.0032 0.0032
Loa Loa (eye worm) hypothetical protein 0.0026 0.0222 0.0222
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0036 0.0432 0.0594
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0036 0.0432 0.0594
Echinococcus multilocularis survival motor neuron protein 1 0.0255 0.4998 0.6864
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0036 0.0432 0.0594
Loa Loa (eye worm) steroid hormone receptor 0.0036 0.0432 0.0432
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0036 0.0432 0.0594
Brugia malayi nuclear receptor NHR-67 0.0017 0.0032 0.0032
Trichomonas vaginalis ap endonuclease, putative 0.0018 0.0056 0.5
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0036 0.0432 0.0432
Onchocerca volvulus 0.0017 0.0032 0.0402
Brugia malayi hypothetical protein 0.0019 0.0075 0.0075
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0051 0.0742 0.0742
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0017 0.0032 0.0043
Entamoeba histolytica protein kinase, putative 0.01 0.1758 1
Schistosoma mansoni metabotropic glutamate receptor 0.0023 0.0153 0.0425
Echinococcus multilocularis thyroid hormone receptor alpha 0.0036 0.0432 0.0594
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Schistosoma mansoni metabotropic glutamate receptor 2 3 (mglur group 2) 0.0053 0.079 0.2204
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0036 0.0432 0.0594
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0133 0.2441 0.2441
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0222 1
Schistosoma mansoni nuclear hormone receptor 0.0017 0.0032 0.0088
Loa Loa (eye worm) hypothetical protein 0.0017 0.0032 0.0032
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0036 0.0432 0.0432
Brugia malayi Nuclear hormone receptor-like 1 0.0019 0.0075 0.0075
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0036 0.0432 0.5489
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0018 0.0056 0.0077
Schistosoma mansoni thyroid hormone receptor 0.0036 0.0432 0.1206
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0052 0.076 0.076
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0222 0.1262
Brugia malayi hypothetical protein 0.0019 0.0075 0.0075
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0036 0.0432 0.0432
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0036 0.0432 0.1206
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.01 0.1758 1

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 4.4 nM Antitumor activity against mouse P388 cells ChEMBL. 18197599
ED50 (functional) = 4.4 nM Antitumor activity against mouse P388 cells ChEMBL. 18197599
GI50 (functional) = 28 nM Cytotoxicity against human MCF7 cells after 48 hrs by sulforhodamine B assay ChEMBL. 26042639

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

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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