Detailed information for compound 765107

Basic information

Technical information
  • TDR Targets ID: 765107
  • Name: 1-(tert-butylamino)-3-(6-methyl-1,2,3,4-tetra hydrocarbazol-9-yl)propan-2-ol
  • MW: 314.465 | Formula: C20H30N2O
  • H donors: 2 H acceptors: 1 LogP: 3.46 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(Cn1c2ccc(cc2c2c1CCCC2)C)CNC(C)(C)C
  • InChi: 1S/C20H30N2O/c1-14-9-10-19-17(11-14)16-7-5-6-8-18(16)22(19)13-15(23)12-21-20(2,3)4/h9-11,15,21,23H,5-8,12-13H2,1-4H3
  • InChiKey: LUUZEOJMIHNBFS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • IDI1_003696
  • ChemDiv2_004981

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
Loa Loa (eye worm) hypothetical protein 0.0072 0.0542 0.0366
Schistosoma mansoni sodium-bile acid cotransporter related 0.0277 0.358 0.3727
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0542 0.5
Brugia malayi MH2 domain containing protein 0.0258 0.3299 0.3297
Loa Loa (eye worm) beta-lactamase 0.0072 0.0542 0.0366
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0542 0.5
Entamoeba histolytica hypothetical protein 0.0074 0.0566 0.5
Echinococcus granulosus GPCR family 2 0.0049 0.0198 0.0198
Brugia malayi RNA binding protein 0.033 0.4371 0.4436
Mycobacterium leprae Probable lipase LipE 0.0072 0.0542 0.5
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0072 0.0542 0.5
Schistosoma mansoni intermediate filament proteins 0.0112 0.113 0.1176
Loa Loa (eye worm) MH2 domain-containing protein 0.0258 0.3299 0.3297
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0054 0.0271 0.0271
Loa Loa (eye worm) RNA binding protein 0.033 0.4371 0.4436
Echinococcus multilocularis beta LACTamase domain containing family member 0.0072 0.0542 0.0542
Loa Loa (eye worm) hypothetical protein 0.0112 0.113 0.099
Schistosoma mansoni sodium-bile acid cotransporter related 0.0683 0.9605 1
Brugia malayi beta-lactamase family protein 0.0072 0.0542 0.0366
Brugia malayi Intermediate filament tail domain containing protein 0.0112 0.113 0.099
Trichomonas vaginalis penicillin-binding protein, putative 0.0072 0.0542 0.5
Trypanosoma cruzi PAB1-binding protein , putative 0.008 0.0652 1
Schistosoma mansoni tar DNA-binding protein 0.033 0.4371 0.4551
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0155 0.1771 0.1672
Echinococcus multilocularis tumor protein p63 0.0709 1 1
Entamoeba histolytica hypothetical protein 0.0074 0.0566 0.5
Brugia malayi hypothetical protein 0.0074 0.0566 0.0391
Loa Loa (eye worm) hypothetical protein 0.011 0.1099 0.0958
Schistosoma mansoni hypothetical protein 0.0049 0.0198 0.0206
Mycobacterium ulcerans esterase/lipase LipP 0.0072 0.0542 0.5
Schistosoma mansoni hypothetical protein 0.0106 0.1043 0.1086
Loa Loa (eye worm) hypothetical protein 0.008 0.0652 0.0482
Schistosoma mansoni lamin 0.0112 0.113 0.1176
Brugia malayi intermediate filament protein 0.0112 0.113 0.099
Schistosoma mansoni tar DNA-binding protein 0.033 0.4371 0.4551
Echinococcus multilocularis musashi 0.0112 0.113 0.113
Mycobacterium ulcerans beta-lactamase 0.0072 0.0542 0.5
Schistosoma mansoni tar DNA-binding protein 0.033 0.4371 0.4551
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0155 0.1771 0.1672
Trichomonas vaginalis esterase, putative 0.0072 0.0542 0.5
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0542 0.0565
Plasmodium falciparum ataxin-2 like protein, putative 0.008 0.0652 0.5
Echinococcus granulosus sodium bile acid cotransporter 0.0683 0.9605 0.9605
Loa Loa (eye worm) transcription factor SMAD2 0.0258 0.3299 0.3297
Schistosoma mansoni lamin 0.0112 0.113 0.1176
Echinococcus granulosus beta LACTamase domain containing family member 0.0072 0.0542 0.0542
Loa Loa (eye worm) hypothetical protein 0.0052 0.0241 0.0045
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0049 0.0198 0.0198
Brugia malayi cytoplasmic intermediate filament protein 0.006 0.0359 0.0171
Mycobacterium leprae conserved hypothetical protein 0.0072 0.0542 0.5
Schistosoma mansoni hypothetical protein 0.0049 0.0198 0.0206
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0054 0.0271 0.0271
Schistosoma mansoni hypothetical protein 0.0049 0.0198 0.0206
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0072 0.0542 0.0565
Trichomonas vaginalis D-aminoacylase, putative 0.0072 0.0542 0.5
Echinococcus multilocularis tar DNA binding protein 0.033 0.4371 0.4371
Trichomonas vaginalis penicillin-binding protein, putative 0.0072 0.0542 0.5
Schistosoma mansoni hypothetical protein 0.0049 0.0198 0.0206
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0462 0.6321 1
Brugia malayi latrophilin 2 splice variant baaae 0.0106 0.1043 0.0898
Trypanosoma brucei PAB1-binding protein , putative 0.008 0.0652 1
Brugia malayi hypothetical protein 0.0051 0.0233 0.0037
Echinococcus granulosus sodium bile acid cotransporter 0.0683 0.9605 0.9605
Entamoeba histolytica hypothetical protein 0.0074 0.0566 0.5
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0072 0.0542 0.0366
Mycobacterium ulcerans hypothetical protein 0.0072 0.0542 0.5
Onchocerca volvulus 0.0683 0.9605 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0155 0.1771 0.1672
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0072 0.0542 0.0366
Loa Loa (eye worm) hypothetical protein 0.0104 0.1011 0.0864
Schistosoma mansoni sodium-bile acid cotransporter 0.0406 0.5495 0.5721
Loa Loa (eye worm) hypothetical protein 0.0072 0.0542 0.0366
Loa Loa (eye worm) TAR-binding protein 0.033 0.4371 0.4436
Echinococcus multilocularis sodium bile acid cotransporter 0.0683 0.9605 0.9605
Loa Loa (eye worm) hypothetical protein 0.0155 0.1771 0.1672
Schistosoma mansoni tar DNA-binding protein 0.033 0.4371 0.4551
Loa Loa (eye worm) hypothetical protein 0.0683 0.9605 1
Onchocerca volvulus 0.0104 0.1011 0.0517
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0049 0.0198 0.0198
Loa Loa (eye worm) hypothetical protein 0.0072 0.0542 0.0366
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0049 0.0198 0.0198
Loa Loa (eye worm) intermediate filament protein 0.0112 0.113 0.099
Echinococcus multilocularis lamin 0.0112 0.113 0.113
Echinococcus granulosus lamin dm0 0.0112 0.113 0.113
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.033 0.4371 0.4436
Echinococcus granulosus intermediate filament protein 0.0112 0.113 0.113
Entamoeba histolytica hypothetical protein 0.0074 0.0566 0.5
Onchocerca volvulus 0.0112 0.113 0.0648
Plasmodium vivax ataxin-2 like protein, putative 0.008 0.0652 1
Leishmania major hypothetical protein, conserved 0.008 0.0652 1
Echinococcus multilocularis sodium bile acid cotransporter 0.0683 0.9605 0.9605
Echinococcus granulosus sodium bile acid cotransporter 0.0683 0.9605 0.9605
Loa Loa (eye worm) hypothetical protein 0.0106 0.1043 0.0898
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.006 0.0359 0.0171
Echinococcus multilocularis sodium bile acid cotransporter 0.0683 0.9605 0.9605
Brugia malayi RNA recognition motif domain containing protein 0.033 0.4371 0.4436
Mycobacterium ulcerans lipase LipD 0.0072 0.0542 0.5
Loa Loa (eye worm) hypothetical protein 0.0052 0.0241 0.0045
Echinococcus granulosus tar DNA binding protein 0.033 0.4371 0.4371
Schistosoma mansoni hypothetical protein 0.0074 0.0566 0.0589
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0112 0.113 0.099
Brugia malayi beta-lactamase family protein 0.0072 0.0542 0.0366
Loa Loa (eye worm) hypothetical protein 0.0072 0.0542 0.0366
Plasmodium falciparum ataxin-2 like protein, putative 0.008 0.0652 0.5
Brugia malayi TAR-binding protein 0.033 0.4371 0.4436
Schistosoma mansoni tar DNA-binding protein 0.033 0.4371 0.4551
Echinococcus multilocularis GPCR, family 2 0.0049 0.0198 0.0198
Loa Loa (eye worm) hypothetical protein 0.0072 0.0542 0.0366
Trypanosoma cruzi PAB1-binding protein , putative 0.008 0.0652 1
Echinococcus granulosus lamin 0.0112 0.113 0.113
Loa Loa (eye worm) hypothetical protein 0.0054 0.0271 0.0077
Brugia malayi beta-lactamase 0.0072 0.0542 0.0366
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0049 0.0198 0.0198
Loa Loa (eye worm) hypothetical protein 0.0072 0.0542 0.0366
Schistosoma mansoni cellular tumor antigen P53 0.0104 0.1011 0.1053
Brugia malayi Sodium Bile acid symporter family protein 0.0683 0.9605 1
Brugia malayi hypothetical protein 0.008 0.0652 0.0482
Schistosoma mansoni transcription factor LCR-F1 0.0074 0.0566 0.0589
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0074 0.0566 0.0566
Echinococcus multilocularis lamin dm0 0.0112 0.113 0.113
Toxoplasma gondii LsmAD domain-containing protein 0.008 0.0652 1
Onchocerca volvulus 0.0112 0.113 0.0648
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0074 0.0566 0.0566

Activities

No activities found for this compound.

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

No literature references available for this target.

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