TDR Targets

Basic information

Technical information

TDR Targets ID: 551194
Name: O2-methyl O3-phenyl 8-azabicyclo[3.2.1]octane -2,3-dicarboxylate
MW: 289.326 | Formula: C16H19NO4
H donors: 1 H acceptors: 2 LogP: 1.82 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: COC(=O)C1C2CCC(N2)CC1C(=O)Oc1ccccc1
InChi: 1S/C16H19NO4/c1-20-16(19)14-12(9-10-7-8-13(14)17-10)15(18)21-11-5-3-2-4-6-11/h2-6,10,12-14,17H,7-9H2,1H3
InChiKey: RERBBBLSJAMJFJ-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

8-azabicyclo[3.2.1]octane-2,3-dicarboxylic acid O2-methyl ester O3-phenyl ester
2-O-methyl 3-O-phenyl 8-azabicyclo[3.2.1]octane-2,3-dicarboxylate
norcocaine
8-azabicyclo[3.2.1]octane-2,3-dicarboxylic acid O2-methyl O3-phenyl ester
1-alpha-H,5-alpha-H-Nortropane-2-beta-carboxylic acid, 3-beta-hydroxy-, methyl ester, benzoate (ester)
METHYL 3-(BENZOYLOXY)-8-AZABICYCLO(3.2.1)OCTANE*

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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0429	0.0738	0.1146
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0913	0.2284	0.5
Onchocerca volvulus	Matrix metalloproteinase homolog	0.2031	0.5854	1
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0429	0.0738	0.1146
Echinococcus multilocularis	Tolloid protein 1	0.0614	0.1328	0.1328
Brugia malayi	Putative carbonic anhydrase 5 precursor	0.0913	0.2284	0.3547
Loa Loa (eye worm)	serotonin transporter b	0.0401	0.065	0.1009
Echinococcus granulosus	carbonic anhydrase II	0.0913	0.2284	0.2284
Loa Loa (eye worm)	matrixin family protein	0.2215	0.6438	1
Loa Loa (eye worm)	hypothetical protein	0.1116	0.293	0.455
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0913	0.2284	0.3547
Loa Loa (eye worm)	matrixin family protein	0.2031	0.5854	0.9092
Loa Loa (eye worm)	hypothetical protein	0.0401	0.065	0.1009
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0913	0.2284	0.3547
Echinococcus multilocularis	carbonic anhydrase	0.0429	0.0738	0.0738
Plasmodium falciparum	carbonic anhydrase	0.0429	0.0738	0.5
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0429	0.0738	0.1146
Loa Loa (eye worm)	hypothetical protein	0.0916	0.2292	0.356
Trypanosoma brucei	carbonic anhydrase-like protein	0.0913	0.2284	0.5
Echinococcus granulosus	carbonic anhydrase	0.0429	0.0738	0.0738
Brugia malayi	Matrix metalloprotease, N-terminal domain containing protein	0.1116	0.293	0.455
Brugia malayi	Matrixin family protein	0.0916	0.2292	0.356
Loa Loa (eye worm)	carbonic anhydrase 3	0.0913	0.2284	0.3547
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0401	0.065	0.1009
Schistosoma mansoni	carbonic anhydrase-related	0.0429	0.0738	0.0306
Echinococcus multilocularis	carbonic anhydrase II	0.0913	0.2284	0.2284
Brugia malayi	Hemopexin family protein	0.1299	0.3514	0.5458
Loa Loa (eye worm)	hypothetical protein	0.025	0.0166	0.0258
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.0589	0.1249	0.2092
Loa Loa (eye worm)	hypothetical protein	0.0429	0.0738	0.1146
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0401	0.065	0.1009
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0429	0.0738	0.1146
Loa Loa (eye worm)	hypothetical protein	0.0429	0.0738	0.1146
Schistosoma mansoni	matrix metallopeptidase-7 (M10 family)	0.0916	0.2292	0.5734
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.0429	0.0738	0.1146
Loa Loa (eye worm)	bone morphogenetic protein 1b	0.0614	0.1328	0.2062
Onchocerca volvulus		0.1299	0.3514	0.5504
Echinococcus multilocularis	carbonic anhydrase	0.0429	0.0738	0.0738
Schistosoma mansoni	carbonic anhydrase-related	0.0429	0.0738	0.0306
Brugia malayi	Matrixin family protein	0.2215	0.6438	1
Brugia malayi	Matrixin family protein	0.0916	0.2292	0.356
Onchocerca volvulus	Matrilysin homolog	0.0916	0.2292	0.3156
Mycobacterium leprae	PROBABLE HYDROLASE	0.1116	0.293	0.5
Loa Loa (eye worm)	matrix metalloproteinase	0.0916	0.2292	0.356
Loa Loa (eye worm)	hypothetical protein	0.0429	0.0738	0.1146
Loa Loa (eye worm)	hypothetical protein	0.0916	0.2292	0.356
Schistosoma mansoni	hypothetical protein	0.1299	0.3514	1
Loa Loa (eye worm)	hypothetical protein	0.0401	0.065	0.1009
Schistosoma mansoni	subfamily M12A unassigned peptidase (M12 family)	0.0614	0.1328	0.2366
Treponema pallidum	sodium- and chloride- dependent transporter	0.0401	0.065	0.5
Onchocerca volvulus		0.0916	0.2292	0.3156
Loa Loa (eye worm)	hypothetical protein	0.0401	0.065	0.1009
Leishmania major	carbonic anhydrase-like protein	0.0913	0.2284	0.5
Brugia malayi	Matrixin family protein	0.0916	0.2292	0.356
Schistosoma mansoni	carbonic anhydrase-related	0.0429	0.0738	0.0306
Brugia malayi	Matrixin family protein	0.0916	0.2292	0.356
Echinococcus granulosus	serotonin transporter	0.0401	0.065	0.065
Echinococcus granulosus	carbonic anhydrase	0.0429	0.0738	0.0738
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.0429	0.0738	0.1146
Echinococcus multilocularis	serotonin transporter	0.0401	0.065	0.065
Mycobacterium tuberculosis	Probable peptidoglycan hydrolase	0.1116	0.293	0.5
Schistosoma mansoni	hypothetical protein	0.0429	0.0738	0.0306
Echinococcus granulosus	Tolloid protein 1	0.0614	0.1328	0.1328
Loa Loa (eye worm)	AStacin protease	0.0384	0.0593	0.0921
Loa Loa (eye worm)	hypothetical protein	0.0916	0.2292	0.356
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.333	1	1
Echinococcus granulosus	carbonic anhydrase	0.0429	0.0738	0.0738
Toxoplasma gondii	hypothetical protein	0.0429	0.0738	1
Onchocerca volvulus	Matrilysin homolog	0.2031	0.5854	1
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0913	0.2284	0.5
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0913	0.2284	0.5704
Schistosoma mansoni	carbonic anhydrase	0.0429	0.0738	0.0306
Echinococcus multilocularis	carbonic anhydrase	0.0429	0.0738	0.0738
Loa Loa (eye worm)	norepinephrine transporter	0.0401	0.065	0.1009
Loa Loa (eye worm)	hypothetical protein	0.0589	0.1248	0.1938
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0913	0.2284	0.5704
Mycobacterium ulcerans	hydrolase	0.1116	0.293	0.5

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

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PubChem: 29230

Bibliographic References

No literature references available for this target.

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Detailed information for compound 551194