Detailed information for compound 280270

Basic information

Technical information
  • TDR Targets ID: 280270
  • Name: N-[1-(dimethylamino)propan-2-yl]-4-methoxyben zo[a]phenazine-11-carboxamide
  • MW: 388.462 | Formula: C23H24N4O2
  • H donors: 1 H acceptors: 3 LogP: 3.6 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cccc2c1ccc1c2nc2c(n1)cccc2C(=O)NC(CN(C)C)C
  • InChi: 1S/C23H24N4O2/c1-14(13-27(2)3)24-23(28)17-8-5-9-18-22(17)26-21-16-7-6-10-20(29-4)15(16)11-12-19(21)25-18/h5-12,14H,13H2,1-4H3,(H,24,28)
  • InChiKey: ACAXGYADTLFREX-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-(dimethylamino)-1-methyl-ethyl]-4-methoxy-benzo[a]phenazine-11-carboxamide
  • N-[2-(dimethylamino)-1-methylethyl]-4-methoxy-11-benzo[a]phenazinecarboxamide
  • N-[1-(dimethylamino)propan-2-yl]-4-methoxy-benzo[a]phenazine-11-carboxamide
  • N-(1-dimethylaminopropan-2-yl)-4-methoxybenzo[j]phenazine-11-carboxamide
  • N-(2-dimethylamino-1-methyl-ethyl)-4-methoxy-benzo[j]phenazine-11-carboxamide
  • N-(2-dimethylamino-1-methylethyl)-4-methoxy-11-benzo[j]phenazinecarboxamide
  • N-(1-dimethylaminopropan-2-yl)-4-methoxy-benzo[j]phenazine-11-carboxamide

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
Entamoeba histolytica protein kinase, putative 0.029 0.2448 1
Echinococcus granulosus tyrosine protein kinase Fyn 0.055 0.7695 0.7695
Echinococcus multilocularis tyrosine protein kinase Src42A 0.055 0.7695 0.7695
Echinococcus multilocularis tyrosine protein kinase Btk29A 0.0297 0.259 0.259
Echinococcus multilocularis tyrosine protein kinase Fyn 0.055 0.7695 0.7695
Echinococcus granulosus tyrosine kinase|tyrosine protein kinase Fyn 0.0422 0.5105 0.5105
Schistosoma mansoni tyrosine kinase 0.055 0.7695 0.7695
Echinococcus multilocularis growth factor receptor bound protein 2 0.026 0.1845 0.1845
Echinococcus granulosus tyrosine protein kinase Btk29A 0.0297 0.259 0.259
Loa Loa (eye worm) sex muscle abnormal protein 5 0.026 0.1845 0.1845
Echinococcus granulosus growth factor receptor bound protein 2 0.026 0.1845 0.1845
Echinococcus multilocularis tyrosine protein kinase Fyn 0.055 0.7695 0.7695
Onchocerca volvulus Vesicular acetylcholine transporter homolog 0.0664 1 1
Schistosoma mansoni vesicular acetylcholine transporter 0.0664 1 1
Echinococcus granulosus proto oncogene tyrosine protein kinase LCK 0.055 0.7695 0.7695
Brugia malayi Tyrosine-protein kinase abl-1 0.0297 0.259 0.259
Echinococcus granulosus tyrosine protein kinase Lyn 0.055 0.7695 0.7695
Echinococcus granulosus tyrosine protein kinase HCK 0.029 0.2448 0.2448
Echinococcus multilocularis tyrosine protein kinase Srms 0.0422 0.5105 0.5105
Echinococcus granulosus vesicular acetylcholine transporter 0.0664 1 1
Echinococcus multilocularis c src tyrosine kinase 0.0297 0.259 0.259
Echinococcus granulosus 3'partial|tyrosine protein kinase Fgr 0.055 0.7695 0.7695
Echinococcus granulosus tyrosine protein kinase Blk 0.0422 0.5105 0.5105
Echinococcus multilocularis tyrosine protein kinase Fyn 0.055 0.7695 0.7695
Echinococcus multilocularis tyrosine protein kinase HCK 0.029 0.2448 0.2448
Echinococcus granulosus tyrosine kinase 0.0422 0.5105 0.5105
Loa Loa (eye worm) vesicular acetylcholine transporter unc-17 0.0664 1 1
Brugia malayi protein-tyrosine kinase 0.0422 0.5105 0.5105
Echinococcus multilocularis vesicular acetylcholine transporter 0.0664 1 1
Echinococcus multilocularis tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase 0.055 0.7695 0.7695
Schistosoma mansoni proto-oncogene tyrosine-protein kinase src 0.0297 0.259 0.259
Schistosoma mansoni proto-oncogene tyrosine-protein kinase abl1 0.026 0.1845 0.1845
Schistosoma mansoni growth factor receptor-bound protein 0.026 0.1845 0.1845
Echinococcus granulosus tyrosine protein kinase Src42A 0.0385 0.4359 0.4359
Echinococcus multilocularis NCK adaptor protein 0.026 0.1845 0.1845
Echinococcus granulosus tyrosine protein kinase Fyn 0.055 0.7695 0.7695
Brugia malayi Variant SH3 domain containing protein 0.026 0.1845 0.1845
Echinococcus multilocularis tyrosine protein kinase Src42A 0.0385 0.4359 0.4359
Schistosoma mansoni nck2/grb4 0.026 0.1845 0.1845
Schistosoma mansoni growth factor receptor-bound protein 0.026 0.1845 0.1845
Echinococcus multilocularis tyrosine protein kinase Fyn 0.0422 0.5105 0.5105
Brugia malayi Sex muscle abnormal protein 5 0.026 0.1845 0.1845
Echinococcus granulosus tyrosine protein kinase Fyn 0.055 0.7695 0.7695
Brugia malayi Variant SH3 domain containing protein 0.026 0.1845 0.1845
Loa Loa (eye worm) variant SH3 domain-containing protein 0.026 0.1845 0.1845
Echinococcus granulosus tyrosine protein kinase Src64B 0.055 0.7695 0.7695
Echinococcus multilocularis tyrosine protein kinase Blk 0.0422 0.5105 0.5105
Loa Loa (eye worm) TK protein kinase 0.0422 0.5105 0.5105
Loa Loa (eye worm) SRC-1 0.055 0.7695 0.7695
Loa Loa (eye worm) TK protein kinase 0.029 0.2448 0.2448
Schistosoma mansoni tyrosine kinase 0.055 0.7695 0.7695
Echinococcus granulosus NCK adaptor protein 0.026 0.1845 0.1845
Echinococcus multilocularis proto oncogene tyrosine protein kinase LCK 0.055 0.7695 0.7695
Echinococcus multilocularis tyrosine protein kinase Fgr 0.055 0.7695 0.7695
Echinococcus multilocularis tyrosine protein kinase Src64B 0.055 0.7695 0.7695
Loa Loa (eye worm) hypothetical protein 0.026 0.1845 0.1845
Echinococcus granulosus tyrosine protein kinase Src42A 0.055 0.7695 0.7695
Schistosoma mansoni tyrosine kinase 0.0297 0.259 0.259
Echinococcus granulosus c src tyrosine kinase 0.0297 0.259 0.259
Schistosoma mansoni tyrosine kinase 0.0297 0.259 0.259
Echinococcus multilocularis tyrosine protein kinase lyn tyrosine protein kinase blk 0.055 0.7695 0.7695
Schistosoma mansoni adapter molecule crk 0.026 0.1845 0.1845
Echinococcus multilocularis tyrosine protein kinase Abl 0.0297 0.259 0.259
Brugia malayi SRC-1 0.055 0.7695 0.7695

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 30 nM Cytotoxicity measured using the H69 parental (H69/P) human small cell lung carcinoma cell line ChEMBL. 11806724
IC50 (functional) = 30 nM Cytotoxicity measured using the H69 parental (H69/P) human small cell lung carcinoma cell line ChEMBL. 11806724
IC50 (functional) = 44 nM Cytotoxicity measured using the drug resistant, P-glycoprotein (Pgp) expressing human small cell lung carcinoma cell line H69/LX4 ChEMBL. 11806724
IC50 (functional) = 44 nM Cytotoxicity measured using the drug resistant, P-glycoprotein (Pgp) expressing human small cell lung carcinoma cell line H69/LX4 ChEMBL. 11806724
Rf (functional) = 1.4 Rf is the resistance factor and is the ratio of the IC50 on the resistant cell line over the IC50 on the parental H69/P cell line ChEMBL. 11806724

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23 11806724

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.

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