Detailed information for compound 606509

Basic information

Technical information
  • TDR Targets ID: 606509
  • Name: 7-hydroxy-2-methoxyphenanthrene-1,4-dione
  • MW: 254.237 | Formula: C15H10O4
  • H donors: 1 H acceptors: 3 LogP: 2.53 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: COC1=CC(=O)c2c(C1=O)ccc1c2ccc(c1)O
  • InChi: 1S/C15H10O4/c1-19-13-7-12(17)14-10-5-3-9(16)6-8(10)2-4-11(14)15(13)18/h2-7,16H,1H3
  • InChiKey: FVUZCFUZMSCPCK-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 7-Hydroxy-2-methoxy-phenanthrene-1,4-dione
  • 7-hydroxy-2-methoxy-phenanthrene-1,4-quinone
  • 1,4-phenanthrenedione, 7-hydroxy-2-methoxy-
  • 7-Hydroxy-2-methoxy-1,4-phenanthrenedione
  • Densiflorol B
  • InChI=1/C15H10O4/c1-19-13-7-12(17)14-10-5-3-9(16)6-8(10)2-4-11(14)15(13)18/h2-7,16H,1H

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
Echinococcus granulosus zinc finger protein 0.002 0.0043 0.0192
Echinococcus granulosus tar DNA binding protein 0.0064 0.0801 0.3585
Echinococcus granulosus fatty acid binding protein FABP2 0.0148 0.2235 1
Echinococcus multilocularis fatty acid binding protein FABP2 0.0148 0.2235 1
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0093 0.0418
Loa Loa (eye worm) lipocalin/cytosolic fatty-acid binding protein family protein 0.0605 1 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0801 0.3585
Loa Loa (eye worm) transcription factor SMAD2 0.0121 0.1767 0.1767
Echinococcus granulosus fatty acid binding protein FABP2 0.0173183 0.188828 1
Schistosoma mansoni fatty acid binding protein 0.0173183 0.188828 0.5
Schistosoma mansoni bromodomain containing protein 0.0063 0.0786 0.3517
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0061 0.0061
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0093 0.0418
Loa Loa (eye worm) hypothetical protein 0.0071 0.0913 0.0913
Brugia malayi Lipocalin / cytosolic fatty-acid binding protein family protein 0.0496072 1 0.5
Echinococcus multilocularis fatty acid binding protein FABP2 0.0173183 0.188828 1
Brugia malayi Bromodomain containing protein 0.0038 0.0361 0.0231
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.0801 0.0801
Echinococcus multilocularis fatty acid binding protein FABP2 0.0173183 0.188828 1
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.0801 0.0677
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0801 0.3585
Schistosoma mansoni hypothetical protein 0.0021 0.0061 0.0272
Echinococcus multilocularis tar DNA binding protein 0.0064 0.0801 0.3585
Brugia malayi RNA binding protein 0.0064 0.0801 0.0677
Loa Loa (eye worm) hypothetical protein 0.0041 0.0403 0.0403
Echinococcus multilocularis fatty acid binding protein FABP2 0.0073 0.0957 0.4281
Schistosoma mansoni zinc finger protein 0.002 0.0043 0.0192
Loa Loa (eye worm) lipocalin/cytosolic fatty-acid binding protein family protein 0.0496072 1 0.5
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0801 0.3585
Echinococcus granulosus fatty acid binding protein FABP2 0.0148 0.2235 1
Echinococcus multilocularis fatty acid binding protein FABP2 0.0148 0.2235 1
Echinococcus multilocularis zinc finger protein 0.002 0.0043 0.0192
Brugia malayi Bromodomain containing protein 0.0075 0.0985 0.0863
Loa Loa (eye worm) MH2 domain-containing protein 0.0121 0.1767 0.1767
Echinococcus granulosus fatty acid binding protein FABP2 0.0173183 0.188828 1
Brugia malayi MH2 domain containing protein 0.0121 0.1767 0.1655
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0036 0.0321 0.1436
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0801 0.3585
Loa Loa (eye worm) bromodomain containing protein 0.0018 0.001 0.001
Schistosoma mansoni fatty acid binding protein 0.0148 0.2235 1
Loa Loa (eye worm) RNA binding protein 0.0064 0.0801 0.0801
Schistosoma mansoni fatty acid binding protein 0.0148 0.2235 1
Brugia malayi TAR-binding protein 0.0064 0.0801 0.0677
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0093 0.0418
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0036 0.0321 0.1436
Echinococcus granulosus fatty acid binding protein, adipocyte 0.0073 0.0957 0.4281
Loa Loa (eye worm) hypothetical protein 0.0043 0.0435 0.0435
Schistosoma mansoni fatty acid binding protein 0.0173183 0.188828 0.5
Loa Loa (eye worm) hypothetical protein 0.0038 0.0363 0.0363
Schistosoma mansoni tar DNA-binding protein 0.0064 0.0801 0.3585
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.006 0.0725 0.3245
Loa Loa (eye worm) TAR-binding protein 0.0064 0.0801 0.0801
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.006 0.0725 0.3245
Echinococcus granulosus fatty acid binding protein FABP2 0.0073 0.0957 0.4281

Activities

Activity type Activity value Assay description Source Reference
CC50 (functional) > 10 uM Huh7 cytotoxicity for Pf inhibitors Novartis-GNF Malaria Box. No reference
CC50 > 10 uM NOVARTIS: Cytotoxicity against human hepatocellular carcinoma cell line (Huh7) ChEMBL. 18579783
EC50 (functional) = 0.2151 uM W2 Pf proliferation inhibition Novartis-GNF Malaria Box. No reference
EC50 (functional) = 0.2151 uM NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
EC50 (functional) = 0.767 uM PF proliferation inhibition 3D7 Novartis-GNF Malaria Box. No reference
EC50 (functional) = 0.767 uM NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay ChEMBL. 18579783
IFI promiscuity index = 0.07018 IFI promiscuity index Novartis-GNF Malaria Box. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 18579783

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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