Detailed information for compound 1487588

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 241.371 | Formula: C17H23N
  • H donors: 0 H acceptors: 0 LogP: 4.48 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: C[C@H]1[C@H](/N=C/c2ccccc2)C[C@@H]2C[C@H]1C2(C)C
  • InChi: 1S/C17H23N/c1-12-15-9-14(17(15,2)3)10-16(12)18-11-13-7-5-4-6-8-13/h4-8,11-12,14-16H,9-10H2,1-3H3/b18-11+/t12-,14+,15-,16-/m1/s1
  • InChiKey: MTHYXCZXIZDHPM-MUSIEBNYSA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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 proprotein convertase subtilisin:kexin type 5 0.4933 0.593 0.593
Mycobacterium tuberculosis Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like) 0.0354 0 0.5
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.0354 0 0.5
Loa Loa (eye worm) endoprotease bli-4 0.8076 1 1
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.1956 0.2075 0.3499
Plasmodium falciparum subtilisin-like protease 2 0.0354 0 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.1956 0.2075 0.3499
Plasmodium vivax subtilisin-like protease 1 0.0354 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Toxoplasma gondii subtilisin SUB4 0.0354 0 0.5
Trichomonas vaginalis neuroendocrine convertase 2 precursor, putative 0.1602 0.1616 0.2726
Plasmodium vivax subtilisin-like serine protease, putative 0.0354 0 0.5
Schistosoma mansoni calcium-activated potassium channel 0.0503 0.0193 0.0193
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.1956 0.2075 0.3499
Echinococcus multilocularis 0.6474 0.7925 1
Loa Loa (eye worm) hypothetical protein 0.3143 0.3611 0.3611
Toxoplasma gondii subtilisin SUB5 0.0354 0 0.5
Schistosoma mansoni hypothetical protein 0.1602 0.1616 0.1616
Toxoplasma gondii subtilisin SUB1 0.0354 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Mycobacterium leprae Possible secreted protease 0.0354 0 0.5
Schistosoma mansoni subfamily S8B non-peptidase homologue (S08 family) 0.1956 0.2075 0.2075
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Plasmodium vivax subtilisin-like protease 2, putative 0.0354 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Echinococcus multilocularis small conductance calcium activated potassium 0.0706 0.0457 0.0576
Mycobacterium ulcerans membrane-anchored mycosin MycP3 0.0354 0 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.4933 0.593 1
Toxoplasma gondii subtilisin SUB9 0.0354 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Plasmodium falciparum subtilisin-like protease 3 0.0354 0 0.5
Trypanosoma cruzi subtilisin peptidase 0.0354 0 0.5
Trichomonas vaginalis hypothetical protein 0.1602 0.1616 0.2726
Echinococcus granulosus small conductance calcium activated potassium 0.0706 0.0457 0.0457
Leishmania major subtilisin-like serine peptidase 0.0354 0 0.5
Brugia malayi proprotein convertase 2 0.5099 0.6144 0.6144
Giardia lamblia High cysteine membrane protein Group 2 0.2977 0.3397 1
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4) 0.0354 0 0.5
Echinococcus multilocularis proprotein convertase subtilisin:kexin type 5 0.4933 0.593 0.7483
Mycobacterium ulcerans membrane-anchored serine protease (mycosin), MycP4 0.0354 0 0.5
Mycobacterium tuberculosis Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5) 0.0354 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Echinococcus multilocularis Furin 1 0.1956 0.2075 0.2618
Mycobacterium leprae PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3) 0.0354 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Onchocerca volvulus 0.0354 0 0.5
Echinococcus granulosus neuroendocrine convertase 2 0.5099 0.6144 0.6144
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.1956 0.2075 0.3499
Schistosoma mansoni subfamily S8B unassigned peptidase (S08 family) 0.8076 1 1
Mycobacterium leprae PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5) 0.0354 0 0.5
Brugia malayi celfurPC protein 0.6474 0.7925 0.7925
Schistosoma mansoni calcium-activated potassium channel 0.0706 0.0457 0.0457
Trypanosoma cruzi serine peptidase, clan SB, family S8-like protein 0.0354 0 0.5
Toxoplasma gondii subtilisin SUB11 0.0354 0 0.5
Trichomonas vaginalis proprotein convertase subtilisin/kexin type, putative 0.1602 0.1616 0.2726
Toxoplasma gondii subtilisin SUB2 0.0354 0 0.5
Echinococcus granulosus furin 0.8076 1 1
Loa Loa (eye worm) hypothetical protein 0.8076 1 1
Toxoplasma gondii subtilisin SUB12 0.0354 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0706 0.0457 0.0457
Toxoplasma gondii subtilisin SUB6 0.0354 0 0.5
Toxoplasma gondii subtilisin SUB7 0.0354 0 0.5
Trypanosoma brucei serine peptidase, clan SB, family S8-like protein 0.0354 0 0.5
Trichomonas vaginalis leucine-rich repeat protein, BspA family 0.1602 0.1616 0.2726
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.4933 0.593 1
Brugia malayi neuroendocrine convertase 1 precursor 0.5099 0.6144 0.6144
Toxoplasma gondii subtilisin SUB10 0.0354 0 0.5
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Plasmodium falciparum subtilisin-like protease 1 0.0354 0 0.5
Toxoplasma gondii subtilisin SUB8 0.0354 0 0.5
Echinococcus multilocularis neuroendocrine convertase 2 0.5099 0.6144 0.7753
Trichomonas vaginalis conserved hypothetical protein 0.1602 0.1616 0.2726
Schistosoma mansoni hypothetical protein 0.0706 0.0457 0.0457
Echinococcus granulosus Furin 1 0.1956 0.2075 0.2075
Trypanosoma cruzi subtilisin-like serine peptidase, putative 0.0354 0 0.5
Loa Loa (eye worm) proprotein convertase 2 0.1956 0.2075 0.2075
Schistosoma mansoni furin-1 (S08 family) 0.3496 0.407 0.407
Trypanosoma brucei subtilisin peptidase 0.0354 0 0.5
Mycobacterium ulcerans proline rich membrane-anchored mycosin MycP5 0.0354 0 0.5
Mycobacterium tuberculosis Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3) 0.0354 0 0.5
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.1956 0.2075 0.3499
Trichomonas vaginalis Clan SB, family S8, subtilisin-like serine peptidase 0.1956 0.2075 0.3499

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.

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