Detailed information for compound 104033

Basic information

Technical information
  • TDR Targets ID: 104033
  • Name: N-(1-methoxy-6-phenyl-6H-benzo[c]chromen-8-yl )propanamide
  • MW: 359.418 | Formula: C23H21NO3
  • H donors: 1 H acceptors: 1 LogP: 4.41 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCC(=O)Nc1ccc2c(c1)C(Oc1c2c(OC)ccc1)c1ccccc1
  • InChi: 1S/C23H21NO3/c1-3-21(25)24-16-12-13-17-18(14-16)23(15-8-5-4-6-9-15)27-20-11-7-10-19(26-2)22(17)20/h4-14,23H,3H2,1-2H3,(H,24,25)
  • InChiKey: DYDOIAFFGMROAL-UHFFFAOYSA-N  

Network

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Synonyms

  • N-(1-methoxy-6-phenyl-6H-benzo[c][1]benzopyran-8-yl)propanamide
  • N-(1-methoxy-6-phenyl-6H-benzo[c]chromen-8-yl)propionamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens nuclear receptor subfamily 3, group C, member 1 (glucocorticoid 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
Mycobacterium ulcerans 3-phosphoshikimate 1-carboxyvinyltransferase 0.0369 0.2793 0.2777
Mycobacterium tuberculosis Probable UDP-N-acetylglucosamine 1-carboxyvinyltransferase MurA 0.094 0.717 1
Schistosoma mansoni smad1 5 8 and 0.0008 0.0025 0.0793
Trypanosoma brucei short-chain dehydrogenase, putative 0.0008 0.0022 0.5
Echinococcus granulosus steroid dehydrogenase 0.0008 0.0022 0.0674
Brugia malayi nuclear receptor NHR-88 0.0009 0.0033 0.0376
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Leishmania major oxidoreductase-like protein 0.0008 0.0022 0.5
Echinococcus granulosus mothers against decapentaplegic 5 0.0008 0.0025 0.0793
Brugia malayi 3-hydroxyacyl-CoA dehydrogenase type II 0.0008 0.0022 0.0246
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0009 0.0033 0.0376
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0009 0.0033 0.0376
Schistosoma mansoni retinoic acid receptor RXR 0.0009 0.0033 0.103
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Trichomonas vaginalis C-MYB, putative 0.001 0.0041 0.9807
Schistosoma mansoni carbonyl reductase 0.0008 0.0022 0.0674
Echinococcus multilocularis conserved hypothetical protein 0.0008 0.0022 0.0674
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Schistosoma mansoni coup transcription factor 0.0009 0.0033 0.103
Loa Loa (eye worm) MH2 domain-containing protein 0.012 0.0881 1
Loa Loa (eye worm) MH1 domain-containing protein 0.0008 0.0025 0.0289
Schistosoma mansoni thyroid hormone receptor 0.0009 0.0033 0.103
Leishmania major hypothetical protein, conserved 0.0008 0.0022 0.5
Loa Loa (eye worm) steroid hormone receptor 0.0009 0.0033 0.0376
Brugia malayi MH1 domain containing protein 0.0008 0.0025 0.0289
Loa Loa (eye worm) hypothetical protein 0.0009 0.0033 0.0376
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0009 0.0033 0.0376
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.001 0.0041 0.9807
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Schistosoma mansoni smad1 5 8 and 0.0008 0.0025 0.0793
Schistosoma mansoni RAR-like nuclear receptor 0.0009 0.0033 0.103
Schistosoma mansoni carbonyl reductase 0.0008 0.0022 0.0674
Echinococcus multilocularis 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0008 0.0022 0.0674
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0009 0.0033 0.103
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.001 0.0041 0.9807
Leishmania major short chain dehydrogenase, putative 0.0008 0.0022 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0008 0.0022 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0008 0.0022 0.5
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.001 0.0041 0.9807
Brugia malayi photoreceptor-specific nuclear receptor 0.0009 0.0033 0.0376
Trypanosoma cruzi quinonoid dihydropteridine reductase, putative 0.0008 0.0022 0.5
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Echinococcus multilocularis steroid dehydrogenase 0.0008 0.0022 0.0674
Schistosoma mansoni retinal dehydrogenase 0.0008 0.0022 0.0674
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0009 0.0033 0.0376
Plasmodium falciparum steroid dehydrogenase, putative 0.0008 0.0022 0.5
Loa Loa (eye worm) dehydrogenase 0.0008 0.0022 0.0246
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0008 0.0022 0.5
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0008 0.0022 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0009 0.0033 0.0376
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0009 0.0033 0.103
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.001 0.0041 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0033 0.0376
Trypanosoma cruzi hypothetical protein, conserved 0.0008 0.0022 0.5
Trypanosoma brucei beta-ketoacyl-ACP reductase 3, putative 0.0008 0.0022 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 0.0033 0.0376
Brugia malayi MH2 domain containing protein 0.0008 0.0025 0.0289
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0008 0.0022 0.5
Toxoplasma gondii shikimate dehydrogenase substrate binding domain-containing protein 0.0369 0.2793 1
Brugia malayi MH2 domain containing protein 0.012 0.0881 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0009 0.0033 0.0376
Trichomonas vaginalis C-MYB, putative 0.001 0.0041 0.9807
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Leishmania major quinonoid dihydropteridine reductase 0.0008 0.0022 0.5
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Echinococcus multilocularis ecdysone induced protein 78C 0.0009 0.0033 0.103
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0008 0.0022 0.5
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Plasmodium vivax steroid dehydrogenase, putative 0.0008 0.0022 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0009 0.0033 0.0376
Echinococcus granulosus oxidoreductase 0.0008 0.0022 0.0674
Trichomonas vaginalis MYB3r3, putative 0.001 0.0041 0.9807
Echinococcus granulosus TGF beta signal transducer SmadC 0.0008 0.0025 0.0793
Echinococcus multilocularis estradiol 17 beta dehydrogenase 12 0.0008 0.0022 0.0674
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0009 0.0033 0.103
Trypanosoma cruzi hypothetical protein, conserved 0.0008 0.0022 0.5
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Echinococcus granulosus hypothetical protein 0.0008 0.0022 0.0674
Leishmania major short chain dehydrogenase, putative 0.0008 0.0022 0.5
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0009 0.0033 0.0376
Brugia malayi Hypothetical oxidoreductase F56D1.5 0.0008 0.0022 0.0246
Leishmania major quinonoid dihydropteridine reductase 0.0008 0.0022 0.5
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0009 0.0033 0.0376
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0321 1
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Brugia malayi hypothetical protein 0.0008 0.0022 0.0246
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0009 0.0033 0.103
Leishmania major short chain dehydrogenase/reductase, putative 0.0008 0.0022 0.5
Echinococcus granulosus Dehydrogenase:reductase SDR family 0.0008 0.0022 0.0674
Echinococcus granulosus ecdysone induced protein 78C 0.0009 0.0033 0.103
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Echinococcus multilocularis smad 0.0008 0.0025 0.0793
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Trypanosoma cruzi hypothetical protein, conserved 0.0008 0.0022 0.5
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0009 0.0033 0.103
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Schistosoma mansoni oxidoreductase short chain dehydrogenase/reductase family 0.0008 0.0022 0.0674
Schistosoma mansoni Smad4 0.0008 0.0025 0.0793
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0321 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0321 1
Echinococcus multilocularis 3 ketodihydrosphingosine reductase 0.0008 0.0022 0.0674
Leishmania major quinonoid dihydropteridine reductase 0.0008 0.0022 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.0008 0.0022 0.5
Trichomonas vaginalis MYB, putative 0.001 0.0041 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0033 0.0376
Onchocerca volvulus Bile acid receptor homolog 0.0009 0.0033 1
Leishmania major pteridine reductase 1 0.0008 0.0022 0.5
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0009 0.0033 0.103
Brugia malayi MH1 domain containing protein 0.0008 0.0025 0.0289
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Schistosoma mansoni carbonyl reductase 0.0008 0.0022 0.0674
Echinococcus multilocularis retinol dehydrogenase 11 0.0008 0.0022 0.0674
Mycobacterium ulcerans short chain dehydrogenase 0.0555 0.422 0.4207
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0321 1
Brugia malayi dehydrogenases, short chain protein 2 0.0008 0.0022 0.0246
Leishmania major hypothetical protein, conserved 0.0008 0.0022 0.5
Schistosoma mansoni thyroid hormone receptor 0.0009 0.0033 0.103
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0009 0.0033 0.0376
Trypanosoma brucei 3-keto-dihydrosphingosine reductase 0.0008 0.0022 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0008 0.0022 0.5
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0008 0.0022 0.5
Leishmania major hypothetical protein, conserved 0.0008 0.0022 0.5
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Echinococcus multilocularis FTZ F1 alpha 0.0009 0.0033 0.103
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0009 0.0033 0.103
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0008 0.0022 0.5
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0008 0.0022 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0008 0.0022 0.0674
Loa Loa (eye worm) transcription factor SMAD2 0.012 0.0881 1
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0009 0.0033 0.0376
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Treponema pallidum UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1309 1 0.5
Echinococcus granulosus epidermal retinal dehydrogenase 2 0.0008 0.0022 0.0674
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0009 0.0033 0.103
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.001 0.0041 0.9807
Trypanosoma brucei short-chain dehydrogenase, putative 0.0008 0.0022 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0009 0.0033 0.103
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.001 0.0041 1
Echinococcus multilocularis retinol dehydrogenase 11 0.0008 0.0022 0.0674
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Echinococcus granulosus carbonyl reductase 1 0.0008 0.0022 0.0674
Leishmania major short chain dehydrogenase-like protein 0.0008 0.0022 0.5
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Echinococcus multilocularis thyroid hormone receptor alpha 0.0009 0.0033 0.103
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.001 0.0041 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0009 0.0033 0.103
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0009 0.0033 1
Leishmania major 3-oxoacyl-(acyl-carrier protein) reductase, putative 0.0008 0.0022 0.5
Leishmania major 3-keto-dihydrosphingosine reductase 0.0008 0.0022 0.5
Leishmania major hypothetical protein, conserved 0.0008 0.0022 0.5
Toxoplasma gondii Myb family DNA-binding domain-containing protein 0.001 0.0041 0.007
Mycobacterium tuberculosis Probable oxidoreductase 0.0555 0.422 0.5873
Loa Loa (eye worm) MH2 domain-containing protein 0.0008 0.0025 0.0289
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0008 0.0022 0.5
Echinococcus multilocularis carbonyl reductase 1 0.0008 0.0022 0.0674
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0008 0.0022 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0009 0.0033 0.103
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0321 1
Mycobacterium leprae PROBABLE UDP-N-ACETYLGLUCOSAMINE 1-CARBOXYVINYLTRANSFERASE MURA 0.094 0.717 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0009 0.0033 0.103
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0321 0.3647
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0009 0.0033 0.0376
Echinococcus multilocularis carbonyl reductase 1 0.0008 0.0022 0.0674
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0009 0.0033 0.0376
Plasmodium falciparum conserved Plasmodium protein, unknown function 0.0008 0.0022 0.5
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Schistosoma mansoni steroid hormone receptor ad4bp 0.0009 0.0033 0.103
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Brugia malayi D-beta-hydroxybutyrate dehydrogenase, mitochondrial precursor 0.0008 0.0022 0.0246
Leishmania major short chain dehydrogenase/reductase, putative 0.0008 0.0022 0.5
Brugia malayi MH2 domain containing protein 0.0008 0.0025 0.0289
Brugia malayi ecdysteroid receptor 0.0009 0.0033 0.0376
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Brugia malayi steroid hormone receptor 0.0009 0.0033 0.0376
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Leishmania major quinonoid dihydropteridine reductase 0.0008 0.0022 0.5
Echinococcus multilocularis transient receptor potential cation channel 0.0008 0.0022 0.0674
Echinococcus multilocularis carbonyl reductase 1 0.0008 0.0022 0.0674
Brugia malayi Steroid receptor seven-up type 2 0.0009 0.0033 0.0376
Leishmania major dehydrogenase-like protein 0.0008 0.0022 0.5
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0008 0.0022 0.5
Brugia malayi Retinol dehydrogenase 12 0.0008 0.0022 0.0246
Echinococcus granulosus carbonyl reductase 1 0.0008 0.0022 0.0674
Echinococcus granulosus hypothetical protein 0.0008 0.0022 0.0674
Schistosoma mansoni short-chain dehydrogenase/reductase 0.0008 0.0022 0.0674
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0009 0.0033 0.0376
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.001 0.0041 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0009 0.0033 0.103
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Onchocerca volvulus 0.0009 0.0033 1
Plasmodium vivax hypothetical protein, conserved 0.0008 0.0022 0.5
Mycobacterium ulcerans UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1309 1 1
Trypanosoma brucei beta-D-hydroxybutyrate dehydrogenase 0.0008 0.0022 0.5
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0008 0.0022 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0321 1
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.001 0.0041 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Echinococcus multilocularis retinol dehydrogenase 13 0.0008 0.0022 0.0674
Brugia malayi Dehydrogenases, short chain protein 30 0.0008 0.0022 0.0246
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Wolbachia endosymbiont of Brugia malayi UDP-N-acetylglucosamine 1-carboxyvinyltransferase 0.1309 1 1
Trichomonas vaginalis pc-MYB2, putative 0.001 0.0041 0.9807
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0008 0.0022 0.5
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Echinococcus granulosus WW domain containing oxidoreductase 0.0008 0.0022 0.0674
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0009 0.0033 0.0376
Loa Loa (eye worm) dehydrogenase 0.0008 0.0022 0.0246
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0009 0.0033 0.103
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0009 0.0033 0.0376
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0009 0.0033 0.0376
Loa Loa (eye worm) hypothetical protein 0.0009 0.0033 0.0376
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.001 0.0041 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0009 0.0033 0.0376
Echinococcus multilocularis oxidoreductase 0.0008 0.0022 0.0674
Onchocerca volvulus Protein ultraspiracle homolog 0.0009 0.0033 1
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Leishmania major quinonoid dihydropteridine reductase 0.0008 0.0022 0.5
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0009 0.0033 0.103
Loa Loa (eye worm) short chain dehydrogenase/reductase family oxidoreductase 0.0008 0.0022 0.0246
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0009 0.0033 0.103
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0009 0.0033 0.103
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Trypanosoma brucei oxidoreductase-like protein 0.0008 0.0022 0.5
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Trypanosoma cruzi hypothetical protein, conserved 0.0008 0.0022 0.5
Trypanosoma brucei short-chain dehydrogenase, putative 0.0008 0.0022 0.5
Leishmania major quinonoid dihydropteridine reductase 0.0008 0.0022 0.5
Echinococcus multilocularis steroid dehydrogenase 0.0008 0.0022 0.0674
Leishmania major hypothetical protein, conserved 0.0008 0.0022 0.5
Trichomonas vaginalis pc-MYB2, putative 0.001 0.0041 0.9807
Echinococcus granulosus 3 hydroxyacyl coenzyme A dehydrogenase type 2 0.0008 0.0022 0.0674
Echinococcus multilocularis mothers against decapentaplegic 5 0.0008 0.0025 0.0793
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0009 0.0033 0.103
Schistosoma mansoni 3-hydroxyacyl-CoA dehydrogenase 0.0008 0.0022 0.0674
Giardia lamblia Myb 1-like protein 0.001 0.0041 1
Echinococcus multilocularis Dehydrogenase:reductase SDR family 0.0008 0.0022 0.0674
Loa Loa (eye worm) Smad1 0.0008 0.0025 0.0289
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0321 1
Loa Loa (eye worm) hypothetical protein 0.0009 0.0033 0.0376
Loa Loa (eye worm) hypothetical protein 0.0009 0.0033 0.0376
Plasmodium falciparum oxidoreductase, short-chain dehydrogenase family, putative 0.0008 0.0022 0.5
Brugia malayi Smad1 0.0008 0.0025 0.0289
Echinococcus granulosus FTZ F1 alpha 0.0009 0.0033 0.103
Echinococcus granulosus retinol dehydrogenase 11 0.0008 0.0022 0.0674
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0008 0.0022 0.5
Loa Loa (eye worm) hypothetical protein 0.0009 0.0033 0.0376
Schistosoma mansoni smad1 5 8 and 0.0008 0.0025 0.0793
Echinococcus granulosus Smad4 0.0008 0.0025 0.0793
Echinococcus granulosus carbonyl reductase 1 0.0008 0.0022 0.0674
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Schistosoma mansoni steroid dehydrogenase 0.0008 0.0022 0.0674
Schistosoma mansoni 3-keto-dihydrosphingosine reductase 0.0008 0.0022 0.0674
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Trypanosoma cruzi short chain dehydrogenase, putative 0.0008 0.0022 0.5
Entamoeba histolytica myb-like DNA-binding domain containing protein 0.001 0.0041 1
Echinococcus granulosus smad 0.0008 0.0025 0.0793
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0008 0.0022 0.5
Echinococcus granulosus carbonyl reductase 1 0.0008 0.0022 0.0674
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.001 0.0041 0.9807
Trypanosoma brucei 3-ketoacyl-CoA reductase, putative 0.0008 0.0022 0.5
Schistosoma mansoni TGF-beta signal transducer Smad2 0.0008 0.0025 0.0793
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0008 0.0022 0.0246
Loa Loa (eye worm) oxidoreductase 0.0008 0.0022 0.0246
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0009 0.0033 0.103
Brugia malayi dehydrogenases, short chain protein 9 0.0008 0.0022 0.0246
Brugia malayi Nuclear hormone receptor-like 1 0.0009 0.0033 0.0376
Echinococcus multilocularis Smad4 0.0008 0.0025 0.0793
Schistosoma mansoni nuclear hormone receptor 0.0009 0.0033 0.103
Brugia malayi oxidoreductase 0.0008 0.0022 0.0246
Echinococcus multilocularis TGF beta signal transducer SmadC 0.0008 0.0025 0.0793
Trichomonas vaginalis MYB72, putative 0.001 0.0041 0.9807
Trichomonas vaginalis r2r3-MYB transcription factor, putative 0.001 0.0041 0.9807
Echinococcus granulosus retinol dehydrogenase 11 0.0008 0.0022 0.0674
Echinococcus granulosus 3 ketodihydrosphingosine reductase 0.0008 0.0022 0.0674
Trypanosoma brucei short-chain dehydrogenase, putative 0.0008 0.0022 0.5
Loa Loa (eye worm) hypothetical protein 0.0008 0.0022 0.0246
Schistosoma mansoni short chain dehydrogenase 0.0008 0.0022 0.0674
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0009 0.0033 0.0376
Brugia malayi nuclear hormone receptor 0.0009 0.0033 0.0376
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0321 0.3647
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0009 0.0033 0.0376
Brugia malayi Dehydrogenases, short chain protein 2 0.0008 0.0022 0.0246
Trypanosoma brucei beta-ketoacyl-ACP reductase 2 0.0008 0.0022 0.5
Mycobacterium leprae probable 3-phosphoshikimate 1-carboxyvinyl transferase AroA (5-ENOLPYRUVYLSHIKIMATE-3-PHOSPHATE SYNTHASE) (EPSP SYNTHASE) (EPSPS 0.0369 0.2793 0.3876
Echinococcus multilocularis epidermal retinal dehydrogenase 2 0.0008 0.0022 0.0674
Brugia malayi hypothetical protein 0.0008 0.0022 0.0246
Trypanosoma cruzi short chain dehydrogenase, putative 0.0008 0.0022 0.5
Schistosoma mansoni smad 0.0008 0.0025 0.0793

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 124 nM Effect on human Glucocorticoid receptor (GR) in a whole cell assay to measure functional cellular GR-antagonism (GRAF) ChEMBL. 15080982
IC50 (functional) = 124 nM Effect on human Glucocorticoid receptor (GR) in a whole cell assay to measure functional cellular GR-antagonism (GRAF) ChEMBL. 15080982
IC50 (binding) = 160 nM Displacement of [3H]-dexamethasone from human Glucocorticoid receptor (GR); Value ranges from 159-161 nM ChEMBL. 15080982
IC50 (binding) = 160 nM Displacement of [3H]-dexamethasone from human Glucocorticoid receptor (GR); Value ranges from 159-161 nM ChEMBL. 15080982

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.
 
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External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

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