TDR Targets

Basic information

Technical information

TDR Targets ID: 330182
Name: 1,4-dihydronaphthalene-2-carboxylic acid
MW: 174.196 | Formula: C11H10O2
H donors: 1 H acceptors: 2 LogP: 2.25 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: OC(=O)C1=CCc2c(C1)cccc2
InChi: 1S/C11H10O2/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-4,6H,5,7H2,(H,12,13)
InChiKey: ZEPJITYWIPTURQ-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

1,4-Dihydro-.beta.-naphthoic acid
2-Naphthalenecarboxylic acid, 1,4-dihydro-

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 granulosus	cathepsin b	0.1625	1	1
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0592	0.2322	1
Brugia malayi	Cathepsin L-like cysteine proteinase	0.035	0.0521	0.0521
Echinococcus multilocularis	cysteine protease	0.05	0.1637	0.1637
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Plasmodium vivax	vivapain-2	0.05	0.1637	1
Onchocerca volvulus		0.05	0.1637	1
Schistosoma mansoni	cathepsin F (C01 family)	0.05	0.1637	0.1637
Onchocerca volvulus	Cathepsin L homolog	0.05	0.1637	1
Trypanosoma cruzi	cysteine peptidase, putative	0.05	0.1637	0.1637
Echinococcus multilocularis	cysteine protease	0.05	0.1637	0.1637
Toxoplasma gondii	cathepsin B	0.0592	0.2322	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.05	0.1637	0.1637
Onchocerca volvulus	Cathepsin L homolog	0.05	0.1637	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.05	0.1637	0.1637
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Echinococcus multilocularis	cathepsin L cysteine protease	0.05	0.1637	0.1637
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1625	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.05	0.1637	0.7051
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0592	0.2322	0.2322
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051
Loa Loa (eye worm)	ctsf protein	0.05	0.1637	0.1177
Entamoeba histolytica	cysteine proteinase, putative	0.05	0.1637	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Echinococcus multilocularis	cathepsin b	0.1625	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.1625	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Onchocerca volvulus		0.05	0.1637	1
Brugia malayi	Cathepsin L-like precursor	0.05	0.1637	0.1637
Trypanosoma cruzi	cysteine peptidase, putative	0.05	0.1637	0.1637
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.05	0.1637	1
Brugia malayi	Cathepsin L-like precursor	0.035	0.0521	0.0521
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.05	0.1637	0.7051
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.035	0.0521	0.0521
Giardia lamblia	Cathepsin B precursor	0.0592	0.2322	0.5
Giardia lamblia	Cathepsin B precursor	0.0592	0.2322	0.5
Trypanosoma cruzi	cysteine peptidase, putative	0.05	0.1637	0.1637
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0592	0.2322	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Onchocerca volvulus		0.05	0.1637	1
Echinococcus multilocularis	cathepsin b	0.1625	1	1
Loa Loa (eye worm)	hypothetical protein	0.1625	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Brugia malayi	Cathepsin L-like precursor	0.05	0.1637	0.1637
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051
Brugia malayi	Cathepsin L-like precursor	0.035	0.0521	0.0521
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Echinococcus granulosus	cathepsin l1	0.035	0.0521	0.0521
Loa Loa (eye worm)	cathepsin B	0.0592	0.2322	0.19
Brugia malayi	Cathepsin L-like precursor	0.05	0.1637	0.1637
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Brugia malayi	cathepsin L-like precursor	0.035	0.0521	0.0521
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.05	0.1637	0.1177
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Giardia lamblia	Cathepsin B precursor	0.0592	0.2322	0.5
Echinococcus granulosus	cathepsin b	0.1625	1	1
Brugia malayi	Cathepsin L-like precursor	0.05	0.1637	0.1637
Onchocerca volvulus		0.05	0.1637	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0592	0.2322	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.05	0.1637	1
Loa Loa (eye worm)	cysteine protease	0.05	0.1637	0.1177
Schistosoma mansoni	cathepsin F (C01 family)	0.05	0.1637	0.1637
Entamoeba histolytica	cysteine protease, putative	0.05	0.1637	1
Onchocerca volvulus		0.05	0.1637	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.05	0.1637	0.1177
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Loa Loa (eye worm)	hypothetical protein	0.05	0.1637	0.1177
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1625	1	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.05	0.1637	0.1637
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.05	0.1637	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.1625	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.0521	0.2243
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0592	0.2322	0.2322
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.1625	1	1
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.05	0.1637	0.1637
Schistosoma mansoni	cathepsin F (C01 family)	0.035	0.0521	0.0521
Trypanosoma cruzi	cysteine peptidase, putative	0.05	0.1637	0.1637
Echinococcus granulosus	cathepsin l1	0.05	0.1637	0.1637
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Trypanosoma cruzi	cruzipain precursor, putative	0.05	0.1637	0.1637
Brugia malayi	Papain family cysteine protease containing protein	0.05	0.1637	0.1637
Onchocerca volvulus	Cathepsin F homolog	0.05	0.1637	1
Onchocerca volvulus		0.05	0.1637	1
Brugia malayi	Cathepsin L-like precursor	0.05	0.1637	0.1637
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051
Plasmodium vivax	vivapain-2	0.05	0.1637	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051
Loa Loa (eye worm)	fibroinase	0.05	0.1637	0.1177
Brugia malayi	Cathepsin L-like precursor	0.05	0.1637	0.1637
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.05	0.1637	0.1637
Entamoeba histolytica	cysteine proteinase, putative	0.035	0.0521	0.3182
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.05	0.1637	0.7051
Entamoeba histolytica	cysteine proteinase, putative	0.05	0.1637	1
Onchocerca volvulus		0.05	0.1637	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.05	0.1637	0.7051
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.035	0.0521	0.2243
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.05	0.1637	0.7051

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	0 uM	Concentration required to inhibit growth of human epidermoid carcinoma (KB) cell line; IA= Inactive	ChEMBL.	15317455

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

PubChem: 582378

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 330182