Detailed information for compound 1172921

Basic information

Technical information
  • TDR Targets ID: 1172921
  • Name: 4-(aminomethyl)-N-cyclohexylpyridin-3-amine
  • MW: 205.299 | Formula: C12H19N3
  • H donors: 2 H acceptors: 1 LogP: 2.06 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: NCc1ccncc1NC1CCCCC1
  • InChi: 1S/C12H19N3/c13-8-10-6-7-14-9-12(10)15-11-4-2-1-3-5-11/h6-7,9,11,15H,1-5,8,13H2
  • InChiKey: WUMRWBDWOMSRCA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-(aminomethyl)-N-cyclohexyl-pyridin-3-amine
  • 4-(aminomethyl)-N-cyclohexyl-3-pyridinamine
  • [4-(aminomethyl)-3-pyridyl]-cyclohexyl-amine

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
Toxoplasma gondii t-complex protein beta subunit 0.0026 0.0679 0.449
Brugia malayi hypothetical protein 0.017 0.8831 1
Plasmodium vivax glutathione reductase, putative 0.0041 0.151 1
Brugia malayi glutathione reductase 0.0041 0.151 0.1708
Leishmania major phosphatidylglycerophosphate synthase, putative 0.0019 0.0252 0.1655
Plasmodium falciparum mitochondrial cardiolipin synthase, putative 0.0016 0.0093 0.0602
Echinococcus multilocularis lamin dm0 0.003 0.0921 0.0919
Echinococcus multilocularis thioredoxin glutathione reductase 0.0041 0.1541 0.154
Loa Loa (eye worm) hypothetical protein 0.0083 0.3875 0.4387
Giardia lamblia TCP-1 chaperonin subunit beta 0.0026 0.0679 1
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.003 0.0921 0.1042
Echinococcus granulosus lamin 0.003 0.0921 0.0919
Echinococcus granulosus thioredoxin glutathione reductase 0.0041 0.1541 0.154
Loa Loa (eye worm) T-complex protein 1 0.0026 0.0679 0.0769
Chlamydia trachomatis phospholipase D superfamily protein 0.0016 0.0093 1
Schistosoma mansoni hypothetical protein 0.0191 1 1
Loa Loa (eye worm) hypothetical protein 0.0064 0.2825 0.3199
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0093 0.4468 0.8837
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0026 0.0679 0.0677
Loa Loa (eye worm) hypothetical protein 0.003 0.0921 0.1042
Loa Loa (eye worm) hypothetical protein 0.017 0.8831 1
Echinococcus multilocularis muscleblind protein 1 0.0168 0.8721 0.8721
Trypanosoma cruzi cardiolipin synthetase, putative 0.0034 0.1142 0.756
Schistosoma mansoni hypothetical protein 0.0191 1 1
Echinococcus granulosus intermediate filament protein 0.003 0.0921 0.0919
Echinococcus granulosus cytoplasmic intermediate filament protein 0.0015 0.0031 0.0029
Wolbachia endosymbiont of Brugia malayi cardiolipin synthase 0.0016 0.0093 1
Trypanosoma cruzi trypanothione reductase, putative 0.0041 0.151 1
Echinococcus multilocularis muscleblind protein 0.0168 0.8721 0.8721
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0104 0.5055 1
Plasmodium vivax cardiolipin synthetase, putative 0.0016 0.0093 0.0602
Mycobacterium ulcerans dihydrolipoamide dehydrogenase 0.0014 0.0002 0.5
Echinococcus granulosus phospholipase D 0.0087 0.4116 0.4115
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0104 0.5055 1
Loa Loa (eye worm) cytoplasmic intermediate filament protein 0.0016 0.0123 0.0139
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0093 0.4468 0.8837
Chlamydia trachomatis phospholipase D superfamily protein 0.0016 0.0093 1
Loa Loa (eye worm) hypothetical protein 0.0168 0.8721 0.9875
Trypanosoma brucei cardiolipin synthetase, putative 0.0034 0.1142 0.756
Brugia malayi Phospholipase d protein 1 0.0098 0.4765 0.5395
Schistosoma mansoni CDP-diacylglycerol--glycerol-3-phosphate 3-phosphatidyltransferase 0.0016 0.0093 0.0091
Trypanosoma brucei cardiolipin synthetase 0.0034 0.1142 0.756
Echinococcus multilocularis phospholipase d3 0.0019 0.0252 0.025
Loa Loa (eye worm) hypothetical protein 0.0016 0.0093 0.0105
Loa Loa (eye worm) hypothetical protein 0.0083 0.3875 0.4387
Brugia malayi T-complex protein 1, beta subunit 0.0026 0.0679 0.0767
Loa Loa (eye worm) hypothetical protein 0.0015 0.0031 0.0036
Echinococcus granulosus lamin dm0 0.003 0.0921 0.0919
Brugia malayi Phospholipase D. Active site motif family protein 0.0034 0.1142 0.1291
Loa Loa (eye worm) thioredoxin reductase 0.0041 0.151 0.171
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0041 0.151 0.2985
Schistosoma mansoni intermediate filament proteins 0.003 0.0921 0.0919
Plasmodium falciparum T-complex protein 1 subunit beta 0.0026 0.0679 0.449
Schistosoma mansoni phospholipase D 0.0098 0.4765 0.4764
Loa Loa (eye worm) glutathione reductase 0.0041 0.151 0.171
Plasmodium vivax T-complex protein 1 subunit beta, putative 0.0026 0.0679 0.449
Mycobacterium tuberculosis Probable dehydrogenase 0.0093 0.4468 0.8837
Echinococcus granulosus muscleblind protein 0.0168 0.8721 0.8721
Brugia malayi Phospholipase D. Active site motif family protein 0.0019 0.0252 0.0283
Echinococcus multilocularis phospholipase D1 0.0098 0.4765 0.4764
Brugia malayi T-complex protein 1, beta subunit 0.0026 0.0679 0.0767
Brugia malayi cytoplasmic intermediate filament protein 0.0016 0.0123 0.0137
Echinococcus multilocularis musashi 0.003 0.0921 0.0919
Chlamydia trachomatis phospholipase D endonuclease family protein 0.0016 0.0093 1
Leishmania major trypanothione reductase 0.0041 0.151 1
Mycobacterium ulcerans flavoprotein disulfide reductase 0.0014 0.0002 0.5
Entamoeba histolytica phospholipase D, putative 0.0098 0.4765 1
Schistosoma mansoni lamin 0.003 0.0921 0.0919
Toxoplasma gondii thioredoxin reductase 0.0041 0.151 1
Brugia malayi Muscleblind-like protein 0.0168 0.8721 0.9875
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0093 0.4468 0.8837
Brugia malayi Protein K4 0.0016 0.0093 0.0103
Echinococcus multilocularis geminin 0.0191 1 1
Brugia malayi Thioredoxin reductase 0.0041 0.151 0.1708
Plasmodium vivax phosphatidylglycerophosphate synthase, putative 0.0016 0.0093 0.0602
Loa Loa (eye worm) hypothetical protein 0.003 0.0889 0.1007
Entamoeba histolytica phospholipase D, putative 0.0098 0.4765 1
Plasmodium falciparum glutathione reductase 0.0041 0.151 1
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0026 0.0679 0.0677
Echinococcus granulosus phospholipase D1 0.0098 0.4765 0.4764
Mycobacterium tuberculosis Probable reductase 0.0093 0.4468 0.8837
Trypanosoma brucei trypanothione reductase 0.0041 0.151 1
Onchocerca volvulus 0.003 0.0921 0.078
Trichomonas vaginalis chaperonin-60kD, ch60, putative 0.0026 0.0679 1
Toxoplasma gondii phospholipase D active site domain-containing protein 0.0034 0.1142 0.756
Onchocerca volvulus 0.017 0.8831 1
Trypanosoma brucei T-complex protein 1, beta subunit, putative 0.0026 0.0679 0.449
Chlamydia trachomatis phospholipase D endonuclease family protein 0.0016 0.0093 1
Onchocerca volvulus 0.003 0.0921 0.078
Mycobacterium tuberculosis Probable oxidoreductase 0.0104 0.5055 1
Brugia malayi Intermediate filament tail domain containing protein 0.003 0.0921 0.104
Echinococcus granulosus phospholipase d3 0.0019 0.0252 0.025
Plasmodium falciparum thioredoxin reductase 0.0041 0.151 1
Echinococcus multilocularis lamin 0.003 0.0921 0.0919
Loa Loa (eye worm) intermediate filament protein 0.003 0.0921 0.1042
Mycobacterium ulcerans dihydrolipoamide dehydrogenase, LpdB 0.0014 0.0002 0.5
Trichomonas vaginalis chaperonin, putative 0.0026 0.0679 1
Brugia malayi hypothetical protein 0.0016 0.0093 0.0103
Schistosoma mansoni lamin 0.003 0.0921 0.0919
Entamoeba histolytica phospholipase D active site domain-containing protein 0.0083 0.3875 0.782
Leishmania major cardiolipin synthetase, putative 0.0016 0.0093 0.0602
Loa Loa (eye worm) phospholipase D 0.0019 0.0252 0.0285
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0104 0.5055 1
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0093 0.4468 0.8837
Leishmania major T-complex protein 1, beta subunit, putative 0.0026 0.0679 0.449
Treponema pallidum NADH oxidase 0.0014 0.0002 0.5
Loa Loa (eye worm) hypothetical protein 0.0168 0.8721 0.9875
Loa Loa (eye worm) hypothetical protein 0.0019 0.0252 0.0285
Chlamydia trachomatis phospholipase D endonuclease family protein 0.0016 0.0093 1
Echinococcus multilocularis chaperonin containing TCP1, subunit 2 (beta) 0.0026 0.0679 0.0677
Brugia malayi intermediate filament protein 0.003 0.0921 0.104
Loa Loa (eye worm) hypothetical protein 0.0064 0.2825 0.3199
Plasmodium falciparum phosphatidylglycerophosphate synthase 0.0016 0.0093 0.0602
Echinococcus multilocularis cytoplasmic intermediate filament protein 0.0015 0.0031 0.0029
Echinococcus granulosus chaperonin containing TCP1 subunit 2 beta 0.0026 0.0679 0.0677
Echinococcus multilocularis phospholipase D 0.0087 0.4116 0.4115
Chlamydia trachomatis phospholipase D endonuclease family protein 0.0016 0.0093 1
Plasmodium vivax thioredoxin reductase, putative 0.0041 0.151 1
Trypanosoma cruzi T-complex protein 1, beta subunit, putative 0.0026 0.0679 0.449
Schistosoma mansoni chaperonin containing t-complex protein 1 beta subunit tcpb 0.0026 0.0679 0.0677
Trypanosoma cruzi cardiolipin synthetase, putative 0.0034 0.1142 0.756
Trypanosoma brucei phosphatidylglycerolphosphate synthase, mitochondrial 0.0016 0.0093 0.0602

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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