Detailed information for compound 514489

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 521.689 | Formula: C35H39NO3
  • H donors: 0 H acceptors: 3 LogP: 5.66 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1ccc(cn1)c1ccc(cc1)[C@H]1C[C@]2(C)[C@H]([C@@H](C[C@H]2[C@H]2C1=C1CCC(=O)C=C1CC2)C)C(=O)C1CC1
  • InChi: 1S/C35H39NO3/c1-20-16-30-28-13-10-24-17-26(37)12-14-27(24)32(28)29(18-35(30,2)33(20)34(38)23-8-9-23)22-6-4-21(5-7-22)25-11-15-31(39-3)36-19-25/h4-7,11,15,17,19-20,23,28-30,33H,8-10,12-14,16,18H2,1-3H3/t20-,28+,29-,30+,33-,35+/m1/s1
  • InChiKey: RAYOYPZHJJVWFU-VYRBCWFISA-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

Species Target name Source Bibliographic reference
Homo sapiens progesterone receptor Starlite/ChEMBL References

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
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0019 0.0319 0.0319
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0048 0.132 0.132
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0015 0.0174 0.0855
Echinococcus multilocularis mitogen activated protein kinase 0.0052 0.145 0.145
Echinococcus multilocularis dna polymerase eta 0.0057 0.1636 0.1636
Brugia malayi photoreceptor-specific nuclear receptor 0.0019 0.0319 0.0413
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.1677 1
Brugia malayi Steroid receptor seven-up type 2 0.0019 0.0319 0.0413
Schistosoma mansoni terminal deoxycytidyl transferase 0.0033 0.0779 0.0779
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0033 0.0779 0.0779
Echinococcus multilocularis thyroid hormone receptor alpha 0.0019 0.0319 0.0319
Brugia malayi Importin beta-1 subunit 0.0028 0.0613 0.0791
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0039 0.1001 0.55
Schistosoma mansoni retinoic acid receptor RXR 0.0019 0.0319 0.0319
Brugia malayi isocitrate dehydrogenase 0.0015 0.0174 0.0225
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0019 0.0319 0.0319
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0058 0.1677 0.1677
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0019 0.0319 0.0319
Brugia malayi hypothetical protein 0.0024 0.0491 0.0634
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0019 0.0319 0.0319
Echinococcus multilocularis tumor susceptibility gene 101 protein 0.0067 0.1982 0.1982
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0035 0.0852 0.5316
Leishmania major DNA polymerase kappa, putative 0.0039 0.1001 0.55
Schistosoma mansoni thyroid hormone receptor 0.0019 0.0319 0.0319
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0036 0.089 0.5221
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.0052 0.145 0.8636
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0018 0.0272 0.0272
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0019 0.0319 0.0413
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0613 0.353
Entamoeba histolytica tumor susceptibility gene 101 protein, putative 0.0046 0.1234 0.5728
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0019 0.0319 0.0319
Entamoeba histolytica hypothetical protein 0.0071 0.2129 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0019 0.0319 0.0319
Schistosoma mansoni gabp alpha 0.007 0.2079 0.2079
Loa Loa (eye worm) hypothetical protein 0.0019 0.0319 0.0319
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0019 0.0319 0.0413
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0429 0.2411
Schistosoma mansoni hypothetical protein 0.0015 0.0173 0.0173
Echinococcus multilocularis isocitrate dehydrogenase 0.0015 0.0174 0.0174
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0018 0.0272 0.077
Entamoeba histolytica deoxycytidyl transferase, putative 0.0033 0.0779 0.3555
Echinococcus granulosus importin subunit beta 1 0.0028 0.0613 0.0613
Mycobacterium ulcerans short-chain type dehydrogenase/reductase 0.0058 0.1677 1
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0015 0.0174 0.0855
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0019 0.0319 0.0413
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0019 0.0319 0.0319
Schistosoma mansoni hypothetical protein 0.0173 0.5653 0.5653
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0491 0.2786
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0058 0.1677 0.1677
Brugia malayi RNA, U transporter 1 0.0079 0.2401 0.3102
Brugia malayi Pax transcription factor protein 2 0.0233 0.7741 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0019 0.0319 0.0319
Schistosoma mansoni coup transcription factor 0.0019 0.0319 0.0319
Plasmodium vivax ataxin-2 like protein, putative 0.0024 0.0491 0.633
Trypanosoma brucei DNA polymerase eta, putative 0.0057 0.1636 0.9771
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Schistosoma mansoni tsg101-related 0.0046 0.1234 0.1234
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0015 0.0174 0.0174
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0015 0.0173 0.0173
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0457 0.2584
Brugia malayi MH2 domain containing protein 0.0115 0.3659 0.4728
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0058 0.1673 1
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0058 0.1677 0.2167
Echinococcus granulosus geminin 0.0173 0.5653 0.5653
Loa Loa (eye worm) hypothetical protein 0.0015 0.0173 0.0173
Echinococcus multilocularis GPCR, family 2 0.0015 0.0173 0.0173
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0019 0.0319 0.0319
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0019 0.0319 0.0319
Loa Loa (eye worm) 3-hydroxyacyl-CoA dehydrogenase type II 0.0055 0.154 0.154
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.145 0.8636
Schistosoma mansoni DNA polymerase eta 0.0057 0.1636 0.1636
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0019 0.0319 0.0319
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0019 0.0319 0.0413
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0174 0.0174
Echinococcus multilocularis importin subunit beta 1 0.0028 0.0613 0.0613
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0019 0.0319 0.0319
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0011 0.0023 0.0023
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0019 0.0319 0.0413
Brugia malayi Fli-1 protein 0.0213 0.704 0.9095
Trypanosoma brucei unspecified product 0.0052 0.1452 0.8646
Schistosoma mansoni importin beta-1 0.0028 0.0613 0.0613
Leishmania major hypothetical protein, conserved 0.0024 0.0491 0.2106
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0174 0.0174
Schistosoma mansoni serine/threonine protein kinase 0.0052 0.145 0.145
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0039 0.0983 1
Plasmodium falciparum ATP-dependent DNA helicase Q1 0.0018 0.0272 0.1214
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative 0.003 0.0674 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.132 0.132
Schistosoma mansoni nuclear hormone receptor 0.0019 0.0319 0.0319
Schistosoma mansoni blooms syndrome DNA helicase 0.0035 0.0847 0.0847
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0048 0.132 0.1705
Loa Loa (eye worm) hypothetical protein 0.0019 0.0319 0.0319
Trypanosoma brucei DNA polymerase IV, putative 0.0058 0.1673 1
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0457 0.2584
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0033 0.0779 0.4023
Schistosoma mansoni hypothetical protein 0.0015 0.0173 0.0173
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.145 0.8636
Trypanosoma brucei DNA polymerase IV, putative 0.0052 0.1452 0.8646
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0019 0.0319 0.0413
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0298 1 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0019 0.0319 0.0319
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0058 0.1677 1
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.0052 0.145 1
Brugia malayi steroid hormone receptor 0.0019 0.0319 0.0413
Loa Loa (eye worm) transcription factor SMAD2 0.0115 0.3659 0.3659
Leishmania major DNA polymerase eta, putative 0.0057 0.1636 0.9725
Trypanosoma cruzi DNA polymerase kappa, putative 0.0058 0.1673 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.0648 0.3746
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0019 0.0319 0.0319
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0019 0.0319 0.0319
Brugia malayi nuclear hormone receptor 0.0019 0.0319 0.0413
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0019 0.0319 0.0319
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0018 0.0272 0.0352
Trypanosoma cruzi PAB1-binding protein , putative 0.0024 0.0491 0.2786
Brugia malayi Latrophilin receptor protein 2 0.0015 0.0173 0.0224
Schistosoma mansoni RAR-like nuclear receptor 0.0019 0.0319 0.0319
Entamoeba histolytica hypothetical protein 0.0071 0.2129 1
Loa Loa (eye worm) hypothetical protein 0.006 0.1726 0.1726
Echinococcus granulosus dna polymerase eta 0.0057 0.1636 0.1636
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0033 0.0779 0.0779
Schistosoma mansoni hypothetical protein 0.0173 0.5653 0.5653
Brugia malayi ecdysteroid receptor 0.0019 0.0319 0.0413
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0011 0.0023 0.0023
Trypanosoma brucei DNA polymerase kappa, putative 0.0036 0.089 0.5221
Schistosoma mansoni transcription factor LCR-F1 0.0071 0.2129 0.2129
Loa Loa (eye worm) RecQ helicase 0.0044 0.1168 0.1168
Leishmania major importin beta-1 subunit, putative 0.0023 0.0429 0.1697
Echinococcus granulosus tumor susceptibility gene 101 protein 0.0067 0.1982 0.1982
Trypanosoma brucei DNA polymerase kappa, putative 0.0039 0.1001 0.5897
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0019 0.0319 0.0413
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0019 0.0319 0.0319
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0018 0.0272 0.0352
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0071 0.2129 0.2129
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0174 0.0174
Schistosoma mansoni steroid hormone receptor ad4bp 0.0019 0.0319 0.0319
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.1636 0.1636
Schistosoma mansoni hypothetical protein 0.0033 0.0789 0.0789
Entamoeba histolytica hypothetical protein 0.0023 0.0429 0.1887
Brugia malayi Bloom's syndrome protein homolog 0.0044 0.1168 0.1509
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0018 0.0272 0.0272
Echinococcus granulosus GPCR family 2 0.0015 0.0173 0.0173
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0019 0.0319 0.0319
Brugia malayi Nuclear hormone receptor-like 1 0.0019 0.0319 0.0413
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0071 0.2129 0.2129
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0019 0.0319 0.0319
Echinococcus granulosus bloom syndrome protein 0.0044 0.1168 0.1168
Loa Loa (eye worm) hypothetical protein 0.0036 0.089 0.089
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0789 0.1019
Echinococcus multilocularis GA binding protein alpha chain 0.007 0.2079 0.2079
Brugia malayi hypothetical protein 0.0071 0.2129 0.2751
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0019 0.0319 0.0413
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0039 0.1001 0.55
Echinococcus multilocularis ecdysone induced protein 78C 0.0019 0.0319 0.0319
Echinococcus multilocularis snurportin 1 0.0298 1 1
Schistosoma mansoni DNA helicase recq1 0.0018 0.0272 0.0272
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0019 0.0319 0.0319
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.0648 0.3746
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0019 0.0319 0.0319
Schistosoma mansoni hypothetical protein 0.0011 0.0023 0.0023
Loa Loa (eye worm) steroid hormone receptor 0.0019 0.0319 0.0319
Echinococcus multilocularis bloom syndrome protein 0.0044 0.1168 0.1168
Brugia malayi ImpB/MucB/SamB family protein 0.0033 0.0779 0.1006
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0.0174 0.0174
Loa Loa (eye worm) hypothetical protein 0.0019 0.0319 0.0319
Trypanosoma brucei DNA polymerase kappa, putative 0.0029 0.0648 0.3746
Loa Loa (eye worm) pax transcription factor protein 2 0.0233 0.7741 0.7741
Echinococcus granulosus ecdysone induced protein 78C 0.0019 0.0319 0.0319
Trypanosoma cruzi DNA polymerase eta, putative 0.0057 0.1636 0.9771
Loa Loa (eye worm) hypothetical protein 0.0019 0.0319 0.0319
Trypanosoma cruzi DNA polymerase kappa, putative 0.0058 0.1673 1
Loa Loa (eye worm) hypothetical protein 0.0133 0.4281 0.4281
Loa Loa (eye worm) hypothetical protein 0.0019 0.0319 0.0319
Loa Loa (eye worm) hypothetical protein 0.0019 0.0319 0.0319
Schistosoma mansoni tsg101-related 0.0056 0.1591 0.1591
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.0491 0.3913
Echinococcus multilocularis geminin 0.0173 0.5653 0.5653
Brugia malayi Ets-domain containing protein 0.007 0.2079 0.2686
Plasmodium falciparum ataxin-2 like protein, putative 0.0024 0.0491 0.3913
Schistosoma mansoni thyroid hormone receptor 0.0019 0.0319 0.0319
Entamoeba histolytica hypothetical protein 0.0071 0.2129 1
Brugia malayi hypothetical protein 0.0016 0.019 0.0245
Plasmodium vivax importin-beta 2, putative 0.0028 0.0613 0.8772
Toxoplasma gondii LsmAD domain-containing protein 0.0024 0.0491 0.2481
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0015 0.0174 0.0174
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.0052 0.145 0.145
Trichomonas vaginalis DNA helicase recq, putative 0.0044 0.1168 0.6918
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0052 0.145 0.8636
Brugia malayi Ets-domain containing protein 0.007 0.2079 0.2686
Brugia malayi polk-prov protein 0.0036 0.089 0.115
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0033 0.0779 0.0779
Schistosoma mansoni hypothetical protein 0.0015 0.0173 0.0173
Loa Loa (eye worm) hypothetical protein 0.0033 0.0789 0.0789
Trypanosoma brucei protein kinase, putative 0.0052 0.145 0.8636
Brugia malayi Isocitrate dehydrogenase 0.0015 0.0174 0.0225
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Echinococcus granulosus mitogen activated protein kinase 0.0052 0.145 0.145
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.145 0.8636
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0015 0.0173 0.0173
Trypanosoma cruzi DNA polymerase eta, putative 0.0035 0.0852 0.4991
Echinococcus granulosus GA binding protein alpha chain 0.007 0.2079 0.2079
Brugia malayi hypothetical protein 0.0067 0.1982 0.2561
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0019 0.0319 0.0413
Echinococcus granulosus FTZ F1 alpha 0.0019 0.0319 0.0319
Trichomonas vaginalis DNA helicase recq1, putative 0.0044 0.1168 0.6918
Trypanosoma brucei unspecified product 0.0023 0.0426 0.2392
Trypanosoma cruzi Vps23 core domain containing protein, putative 0.0022 0.0391 0.2177
Brugia malayi ImpB/MucB/SamB family protein 0.0057 0.1636 0.2113
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0033 0.0779 0.0779
Trichomonas vaginalis importin beta-1, putative 0.0023 0.0429 0.2411
Schistosoma mansoni hypothetical protein 0.0298 1 1
Brugia malayi MAP kinase sur-1 0.0052 0.145 0.1873
Leishmania major hypothetical protein, conserved 0.0022 0.0391 0.1441
Schistosoma mansoni hypothetical protein 0.0015 0.0173 0.0173
Trypanosoma brucei unspecified product 0.0023 0.0426 0.2392
Trypanosoma brucei Vps23 core domain containing protein, putative 0.0022 0.0391 0.2177
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0019 0.0319 0.0319
Onchocerca volvulus 0.0233 0.7741 1
Loa Loa (eye worm) hypothetical protein 0.0019 0.0319 0.0319
Giardia lamblia Kinase, CMGC MAPK 0.0052 0.145 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0019 0.0319 0.0413
Loa Loa (eye worm) latrophilin receptor protein 2 0.0015 0.0173 0.0173
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.0052 0.145 0.8636
Echinococcus multilocularis dna polymerase kappa 0.0058 0.1673 0.1673
Trichomonas vaginalis DNA polymerase eta, putative 0.0058 0.1673 1
Echinococcus granulosus mitogen activated protein kinase 3 0.0052 0.145 0.145
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0018 0.0272 0.077
Loa Loa (eye worm) hypothetical protein 0.0018 0.0272 0.0272
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0174 0.0855
Trypanosoma cruzi DNA polymerase kappa, putative 0.0058 0.1673 1
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.007 0.2079 0.2079
Leishmania major DNA polymerase eta, putative 0.0035 0.0852 0.4512
Mycobacterium tuberculosis Probable short-chain type dehydrogenase/reductase 0.0058 0.1677 1
Entamoeba histolytica recQ family helicase, putative 0.0023 0.0457 0.2022
Trypanosoma cruzi importin beta-1 subunit, putative 0.0023 0.0429 0.2411
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0015 0.0173 0.0173
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0018 0.0272 0.0272
Trypanosoma brucei importin beta-1 subunit, putative 0.0028 0.0613 0.353
Trichomonas vaginalis CMGC family protein kinase 0.0052 0.145 0.8636
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0023 0.0457 0.1886
Schistosoma mansoni DNA helicase recq5 0.0018 0.0272 0.0272
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0019 0.0319 0.0319
Plasmodium falciparum importin beta, putative 0.0028 0.0613 0.5423
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.0052 0.145 0.8636
Brugia malayi Calcitonin receptor-like protein seb-1 0.0048 0.132 0.1705
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.0052 0.145 0.8636
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0019 0.0319 0.0319
Loa Loa (eye worm) hypothetical protein 0.0067 0.1982 0.1982
Echinococcus granulosus dna polymerase kappa 0.0058 0.1673 0.1673
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0018 0.0272 0.0272
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0029 0.0662 0.3823
Toxoplasma gondii HEAT repeat-containing protein 0.0028 0.0613 0.3438
Trypanosoma brucei DNA polymerase IV, putative 0.0058 0.1673 1
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0015 0.0173 0.0173
Trypanosoma brucei PAB1-binding protein , putative 0.0024 0.0491 0.2786
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0019 0.0319 0.0413
Loa Loa (eye worm) fli-1 protein 0.0213 0.704 0.704
Entamoeba histolytica hypothetical protein 0.0071 0.2129 1
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0015 0.0174 0.0174
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0174 0.0855
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.0052 0.145 0.8487
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0023 0.0429 0.2411
Loa Loa (eye worm) hypothetical protein 0.0019 0.0319 0.0319
Loa Loa (eye worm) MH2 domain-containing protein 0.0115 0.3659 0.3659
Echinococcus multilocularis FTZ F1 alpha 0.0019 0.0319 0.0319
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.0052 0.145 0.8487
Trichomonas vaginalis hypothetical protein 0.0033 0.0782 0.4564
Loa Loa (eye worm) hypothetical protein 0.0028 0.0613 0.0613
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0019 0.0319 0.0413
Giardia lamblia DINP protein human, muc B family 0.0039 0.1001 0.6187
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0058 0.1677 0.1677
Toxoplasma gondii BRCA1 C Terminus (BRCT) domain-containing protein 0.0017 0.0217 0.0338
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0019 0.0319 0.0413
Trypanosoma brucei DNA polymerase kappa, putative 0.0058 0.1673 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0019 0.0319 0.0319
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0015 0.0173 0.0224
Schistosoma mansoni hypothetical protein 0.0071 0.2129 0.2129
Trichomonas vaginalis DNA helicase recq, putative 0.0023 0.0457 0.2584
Brugia malayi nuclear receptor NHR-88 0.0019 0.0319 0.0413
Schistosoma mansoni ets-related 0.0213 0.704 0.704
Schistosoma mansoni tsg101-related 0.0056 0.1591 0.1591
Trypanosoma cruzi DNA polymerase kappa, putative 0.0058 0.1673 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0019 0.0319 0.0319
Loa Loa (eye worm) hypothetical protein 0.0024 0.0491 0.0491
Echinococcus multilocularis mitogen activated protein kinase 3 0.0052 0.145 0.145
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0018 0.0272 0.0272

Activities

Activity type Activity value Assay description Source Reference
EC50 (functional) = 0.12 nM Agonist activity at human PRB expressed in CHO cells ChEMBL. 18243712
EC50 (functional) = 0.12 nM Agonist activity at human PRB expressed in CHO cells ChEMBL. 18243712
Efficacy (functional) = 42 % Agonist activity at human PRB expressed in CHO cells relative to Org 2058 ChEMBL. 18243712
Efficacy (functional) = 42 % Agonist activity at human PRB expressed in CHO cells relative to Org 2058 ChEMBL. 18243712
Efficacy (functional) = 59 % Antagonist activity at human PRB expressed in CHO cells assessed as inhibition of Org 2058 induced-transactivation relative to Org 31710 ChEMBL. 18243712
Efficacy (functional) = 59 % Antagonist activity at human PRB expressed in CHO cells assessed as inhibition of Org 2058 induced-transactivation relative to Org 31710 ChEMBL. 18243712
IC50 (functional) = 0.63 nM Antagonist activity at human PRB expressed in CHO cells assessed as inhibition of Org 2058 induced-transactivation ChEMBL. 18243712
IC50 (functional) = 0.63 nM Antagonist activity at human PRB expressed in CHO cells assessed as inhibition of Org 2058 induced-transactivation ChEMBL. 18243712

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

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.