TDR Targets

Basic information

Technical information

TDR Targets ID: 169598
Name: N,N-dimethyl-4-(2-methylphenyl)-1,2,3,4-tetra hydronaphthalen-2-amine
MW: 265.393 | Formula: C19H23N
H donors: 0 H acceptors: 0 LogP: 4.5 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: CN(C1Cc2ccccc2C(C1)c1ccccc1C)C
InChi: 1S/C19H23N/c1-14-8-4-6-10-17(14)19-13-16(20(2)3)12-15-9-5-7-11-18(15)19/h4-11,16,19H,12-13H2,1-3H3
InChiKey: PPQJESFHSZPEOS-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

N,N-dimethyl-4-(o-tolyl)tetralin-2-amine
N,N-dimethyl-4-(o-tolyl)-2-tetralinamine
dimethyl-[4-(o-tolyl)tetralin-2-yl]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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	SWI:SNF matrix associated	0.0014	0.0343	0.018
Trypanosoma cruzi	PAB1-binding protein , putative	0.0015	0.0419	0.0423
Trypanosoma cruzi	aminopeptidase, putative	0.0019	0.0756	0.1148
Brugia malayi	Peptidase family M1 containing protein	0.0019	0.0756	0.087
Schistosoma mansoni	hypothetical protein	0.0098	0.6936	1
Schistosoma mansoni	subfamily M14A unassigned peptidase (M14 family)	0.0029	0.1532	0.1951
Onchocerca volvulus	Eukaryotic initiation factor 4A homolog	0.0072	0.4877	0.4695
Trypanosoma brucei	Aminopeptidase M1, putative	0.0019	0.0756	0.0757
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.012	0.8694	1
Echinococcus granulosus	geminin	0.0098	0.6936	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0025	0.1184	0.1433
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0025	0.1184	0.1433
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0072	0.4877	0.4695
Echinococcus multilocularis	SWI:SNF matrix associated	0.0014	0.0343	0.018
Onchocerca volvulus		0.0029	0.1532	0.1231
Echinococcus granulosus	neuropeptide receptor	0.0023	0.1081	0.112
Toxoplasma gondii	eukaryotic initiation factor-4A, putative	0.0072	0.4877	1
Trypanosoma cruzi	Aminopeptidase M1, putative	0.0019	0.0756	0.1148
Trichomonas vaginalis	set domain proteins, putative	0.0137	1	1
Trypanosoma cruzi	metallo-peptidase, clan MA(E), family M1, putative	0.0019	0.0756	0.1148
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0019	0.0756	0.0796
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0025	0.1184	0.1433
Onchocerca volvulus		0.0019	0.0756	0.0428
Loa Loa (eye worm)	hypothetical protein	0.0024	0.1138	0.1081
Schistosoma mansoni	brg-1 associated factor	0.0014	0.0343	0.018
Brugia malayi	brahma associated protein 60 kDa	0.0014	0.0343	0.0394
Entamoeba histolytica	DEAD/DEAH box helicase, putative	0.0072	0.4877	1
Trypanosoma brucei	metallo-peptidase, Clan MA(E) Family M1	0.0019	0.0756	0.0757
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0796
Leishmania major	eukaryotic initiation factor 4a, putative	0.0072	0.4877	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0015	0.0419	0.0168
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0025	0.1184	0.1135
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0627
Echinococcus multilocularis	geminin	0.0098	0.6936	1
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0627
Loa Loa (eye worm)	brahma associated protein	0.0014	0.0343	0.0142
Loa Loa (eye worm)	transcription factor SMAD2	0.0071	0.4835	0.5446
Brugia malayi	SWIB/MDM2 domain containing protein	0.0014	0.0343	0.0394
Onchocerca volvulus		0.0017	0.0593	0.0259
Trypanosoma brucei	Eukaryotic initiation factor 4A-1	0.0072	0.4877	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0015	0.0419	0.0168
Echinococcus granulosus	eukaryotic initiation factor 4A III	0.0072	0.4877	0.6878
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0025	0.1184	0.1276
Treponema pallidum	ATP-dependent RNA helicase	0.0072	0.4877	0.5
Schistosoma mansoni	hypothetical protein	0.0014	0.0343	0.018
Trypanosoma cruzi	PAB1-binding protein , putative	0.0015	0.0419	0.0423
Brugia malayi	hypothetical protein	0.0015	0.0419	0.0482
Loa Loa (eye worm)	aminopeptidase N	0.0019	0.0756	0.0631
Loa Loa (eye worm)	hypothetical protein	0.0072	0.4877	0.5495
Chlamydia trachomatis	SWIB complex protein	0.0014	0.0343	0.5
Schistosoma mansoni	hypothetical protein	0.0014	0.0343	0.018
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0072	0.4877	0.4695
Echinococcus granulosus	histone lysine methyltransferase setb	0.0017	0.0593	0.038
Schistosoma mansoni	neuropeptide receptor	0.0023	0.1081	0.128
Onchocerca volvulus		0.0019	0.0756	0.0428
Echinococcus multilocularis	Peptidase M1, membrane alanine aminopeptidase, N terminal	0.0019	0.0756	0.0796
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0019	0.0756	0.0428
Echinococcus granulosus	aminopeptidase N	0.0019	0.0756	0.0627
Onchocerca volvulus		0.0029	0.1532	0.1231
Mycobacterium tuberculosis	Probable cold-shock DeaD-box protein A homolog DeaD (ATP-dependent RNA helicase dead homolog)	0.0072	0.4877	0.5
Toxoplasma gondii	LsmAD domain-containing protein	0.0015	0.0419	0.0168
Brugia malayi	brahma associated protein 60 kDa	0.0014	0.0343	0.0394
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0419	0.0232
Brugia malayi	Peptidase family M1 containing protein	0.0019	0.0756	0.087
Echinococcus multilocularis	SWI:SNF matrix associated	0.0014	0.0343	0.018
Onchocerca volvulus		0.0029	0.1532	0.1231
Echinococcus multilocularis	eukaryotic initiation factor 4A III	0.0072	0.4877	0.6934
Echinococcus multilocularis	Upstream activation factor subunit UAF30	0.0014	0.0343	0.018
Giardia lamblia	Translation initiation factor eIF-4A, putative	0.0072	0.4877	0.5
Schistosoma mansoni	hypothetical protein	0.0098	0.6936	1
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0627
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0017	0.0593	0.0552
Schistosoma mansoni	hypothetical protein	0.0014	0.0343	0.018
Leishmania major	aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1	0.0019	0.0756	0.0757
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0593	0.0438
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0072	0.4877	1
Brugia malayi	Pre-SET motif family protein	0.012	0.8694	1
Brugia malayi	MH2 domain containing protein	0.0071	0.4835	0.5562
Trichomonas vaginalis	DEAD box ATP-dependent RNA helicase, putative	0.0072	0.4877	0.4695
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0796
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0072	0.4877	0.6934
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0017	0.0593	0.0553
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0019	0.0756	0.0428
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0796
Onchocerca volvulus		0.0029	0.1532	0.1231
Brugia malayi	hypothetical protein	0.0019	0.0756	0.087
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0025	0.1184	0.1362
Leishmania major	eukaryotic initiation factor 4a, putative	0.0072	0.4877	1
Echinococcus multilocularis	eukaryotic initiation factor 4A	0.0072	0.4877	0.6934
Echinococcus multilocularis	subfamily M14A unassigned peptidase	0.0029	0.1532	0.1951
Mycobacterium ulcerans	aminopeptidase N PepN	0.0019	0.0756	0.5
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0627
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0796
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0017	0.0543	0.0304
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0019	0.0756	0.0796
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0025	0.1184	0.1433
Echinococcus multilocularis	neuropeptide receptor	0.0023	0.1081	0.128
Plasmodium vivax	RNA helicase-1, putative	0.0072	0.4877	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0071	0.4835	0.5446
Leishmania major	aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1	0.0019	0.0756	0.0757
Echinococcus multilocularis	G protein coupled receptor 139	0.0023	0.1081	0.128
Trypanosoma brucei	Aminopeptidase M1, putative	0.0019	0.0756	0.0757
Chlamydia trachomatis	DNA topoisomerase I	0.0014	0.0343	0.5
Schistosoma mansoni	DEAD box ATP-dependent RNA helicase	0.0072	0.4877	0.6934
Brugia malayi	eukaryotic initiation factor 4A	0.0072	0.4877	0.561
Brugia malayi	Pre-SET motif family protein	0.0017	0.0593	0.0682
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0017	0.0593	0.0553
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0025	0.1184	0.1433
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0017	0.0593	0.0553
Trypanosoma cruzi	Eukaryotic initiation factor 4A-1	0.0072	0.4877	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0017	0.0593	0.0553
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0025	0.1184	0.1276
Plasmodium falciparum	eukaryotic initiation factor 4A	0.0072	0.4877	1
Plasmodium vivax	SET domain protein, putative	0.0017	0.0593	0.0552
Echinococcus granulosus	subfamily M14A unassigned peptidase	0.0029	0.1532	0.1804
Plasmodium vivax	ataxin-2 like protein, putative	0.0015	0.0419	0.0168
Schistosoma mansoni	cytosol alanyl aminopeptidase (M01 family)	0.0019	0.0756	0.0796
Echinococcus granulosus	eukaryotic initiation factor 4A	0.0072	0.4877	0.6878
Onchocerca volvulus	Subfamily M14A unassigned peptidase homolog	0.0029	0.1532	0.1231
Loa Loa (eye worm)	SWIB/MDM2 domain-containing protein	0.0014	0.0343	0.0142
Echinococcus multilocularis	aminopeptidase N	0.0019	0.0756	0.0796
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0017	0.0593	0.0553
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0017	0.0593	0.0553

Activities

Activity type	Activity value	Assay description	Source	Reference
K0.5 (binding)	= 10.2 nM	Displacement of [3H]-(-)-trans-H2-PAT from histamine H2 PAT binding site by competition binding assay.	ChEMBL.	10447948
K0.5 (binding)	= 10.2 nM	Displacement of [3H]-(-)-trans-H2-PAT from histamine H2 PAT binding site by competition binding assay.	ChEMBL.	10447948
K0.5 (binding)	= 12.7 nM	Compound was tested for the displacement of [3H]-mepyramine from Histamine H1 receptor by competition binding assay.	ChEMBL.	10447948

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

ChEMBL: CHEMBL103775
PubChem: 42601570

Bibliographic References

1 literature reference was collected for this gene.

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

Detailed information for compound 169598