Detailed information for compound 1613334

Basic information

Technical information
  • TDR Targets ID: 1613334
  • Name: 2-Oxobicyclo[2.2.1]heptane-1-carboxylic acid
  • MW: 154.163 | Formula: C8H10O3
  • H donors: 1 H acceptors: 3 LogP: 1.14 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC(=O)C12CCC(C1)CC2=O
  • InChi: 1S/C8H10O3/c9-6-3-5-1-2-8(6,4-5)7(10)11/h5H,1-4H2,(H,10,11)
  • InChiKey: ZKMOOBXRINLMKZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-oxonorbornane-1-carboxylic acid
  • 2-oxo-1-norbornanecarboxylic acid
  • 2-ketonorbornane-1-carboxylic acid
  • NSC670148
  • NCI60_024607
  • AIDS-145400
  • AIDS145400

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
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Entamoeba histolytica DNA topoisomerase II, putative 0.007 0.1254 0.5
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Brugia malayi GnHR receptor homolog 0.004 0.0226 0.0927
Schistosoma mansoni biogenic amine receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) G-protein coupled receptor 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni neuropeptide receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) 5-hydroxytryptamine 2C receptor 0.004 0.0226 0.1799
Loa Loa (eye worm) gonadotropin-releasing hormone receptor 2 0.004 0.0226 0.1799
Schistosoma mansoni amine GPCR 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni biogenic amine (dopamine) receptor 0.004 0.0226 0.0927
Mycobacterium leprae Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) 0.0154 0.4161 1
Schistosoma mansoni biogenic amine receptor 0.004 0.0226 0.0927
Schistosoma mansoni ancient conserved domain protein 2 (cyclin m2) 0.004 0.0226 0.0927
Trypanosoma brucei DNA topoisomerase ii 0.0123 0.3102 1
Loa Loa (eye worm) neuropeptide F receptor 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Giardia lamblia DNA topoisomerase II 0.0065 0.1086 0.5
Brugia malayi RE15519p 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.0037 0.0121 0.0961
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni opsin-like receptor 0.004 0.0226 0.0927
Brugia malayi gonadotropin-releasing hormone receptor 2 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni thyrotropin-releasing hormone receptor 0.004 0.0226 0.0927
Brugia malayi Probable DNA topoisomerase II 0.007 0.1254 1
Schistosoma mansoni opsin-like receptor 0.004 0.0226 0.0927
Schistosoma mansoni muscarinic acetylcholine (GAR) receptor 0.004 0.0226 0.0927
Brugia malayi neuropeptide F receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) melatonin receptor type 1A 0.004 0.0226 0.1799
Brugia malayi AKH receptor 0.004 0.0226 0.0927
Brugia malayi putative neuropeptide receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni neuropeptide F-like receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.0054 0.0713 0.5682
Brugia malayi Dopamine receptor protein 1 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Brugia malayi Dopamine receptor 0.004 0.0226 0.0927
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Schistosoma mansoni histamine h1 receptor 0.004 0.0226 0.0927
Schistosoma mansoni biogenic amine (5HT) receptor 0.004 0.0226 0.0927
Schistosoma mansoni histamine-responsive GPCR (AAF21638) 0.004 0.0226 0.0927
Schistosoma mansoni amine GPCR 0.004 0.0226 0.0927
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Schistosoma mansoni amine GPCR 0.004 0.0226 0.0927
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0123 0.3102 1
Schistosoma mansoni hypothetical protein 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni neuropeptide receptor 0.004 0.0226 0.0927
Schistosoma mansoni myosin xvIII 0.004 0.0226 0.0927
Loa Loa (eye worm) G-protein-linked acetylcholine receptor protein 2 0.004 0.0226 0.1799
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Brugia malayi Calcitonin receptor-like protein seb-1 0.0054 0.0713 0.5223
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Leishmania major mitochondrial DNA topoisomerase II 0.0123 0.3102 1
Brugia malayi sulfakinin receptor protein 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0054 0.0713 0.5682
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Brugia malayi Melatonin receptor type 1A 0.004 0.0226 0.0927
Brugia malayi G protein-coupled receptor 0.004 0.0226 0.0927
Onchocerca volvulus DNA topoisomerase 2 homolog 0.007 0.1254 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) unidentified vitellogenin-linked transcript protein 6 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni neuropeptide receptor 0.004 0.0226 0.0927
Schistosoma mansoni hypothetical protein 0.004 0.0226 0.0927
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.004 0.0226 0.0927
Schistosoma mansoni adenoreceptor 0.004 0.0226 0.0927
Schistosoma mansoni peptide (FMRFamide/somatostatin)-like receptor 0.004 0.0226 0.0927
Brugia malayi G-protein coupled receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) TOPoisomerase family member 0.007 0.1254 1
Brugia malayi neuropeptide F receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Loa Loa (eye worm) follicle stimulating hormone receptor 0.004 0.0226 0.1799
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.009 0.1943 0.0788
Echinococcus granulosus DNA topoisomerase 2 alpha 0.007 0.1254 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni amine GPCR 0.004 0.0226 0.0927
Schistosoma mansoni biogenic amine (5HT) receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni growth hormone secretagogue receptor 0.004 0.0226 0.0927
Schistosoma mansoni DNA topoisomerase II 0.007 0.1254 1
Brugia malayi Serotonin receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.004 0.0226 0.0927
Loa Loa (eye worm) G-protein coupled receptor 0.004 0.0226 0.1799
Schistosoma mansoni biogenic amine (octopamine/dopamine) receptor 0.004 0.0226 0.0927
Schistosoma mansoni biogenic amine receptor 0.004 0.0226 0.0927
Schistosoma mansoni biogenic amine (dopamine) receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Brugia malayi Dopamine receptor protein 2 0.004 0.0226 0.0927
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0123 0.3102 1
Brugia malayi G-protein coupled receptor 0.004 0.0226 0.0927
Schistosoma mansoni alpha-1 adrenergic receptor 0.004 0.0226 0.0927
Trichomonas vaginalis DNA topoisomerase II, putative 0.007 0.1254 0.5
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni hypothetical protein 0.004 0.0226 0.0927
Schistosoma mansoni opsin-like receptor 0.004 0.0226 0.0927
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.004 0.0226 0.0927
Brugia malayi ORL1-like opioid receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Onchocerca volvulus DNA topoisomerase 2 homolog 0.007 0.1254 1
Chlamydia trachomatis DNA gyrase subunit B 0.0102 0.236 0.236
Brugia malayi Serotonin/octopamine receptor family protein 7 0.004 0.0226 0.0927
Schistosoma mansoni neuropeptide F-like receptor 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) neuropeptide F receptor 0.004 0.0226 0.1799
Brugia malayi G protein-coupled receptor F59B2.13 0.004 0.0226 0.0927
Loa Loa (eye worm) TYRA-2 protein 0.004 0.0226 0.1799
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Brugia malayi Serotonin receptor 0.004 0.0226 0.0927
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.007 0.1254 1
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.004 0.0226 0.0927
Plasmodium falciparum DNA gyrase subunit B 0.0155 0.4208 0.3378
Brugia malayi follicle stimulating hormone receptor 0.004 0.0226 0.0927
Schistosoma mansoni neuropeptide receptor 0.004 0.0226 0.0927
Plasmodium vivax DNA gyrase subunit B, putative 0.0155 0.4208 0.3378
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Brugia malayi larval opioid receptor 0.004 0.0226 0.0927
Chlamydia trachomatis DNA gyrase subunit B 0.0155 0.4208 0.4208
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni amine GPCR 0.004 0.0226 0.0927
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.007 0.1254 1
Brugia malayi DNA topoisomerase II, alpha isozyme 0.007 0.1254 1
Schistosoma mansoni peptide (allatostatin)-like receptor 0.004 0.0226 0.0927
Brugia malayi hypothetical protein 0.004 0.0226 0.0927
Schistosoma mansoni peptide (allatostatin/somatostatin)-like receptor 0.004 0.0226 0.0927
Brugia malayi Tachykinin-like peptides receptor 99D 0.004 0.0226 0.0927
Schistosoma mansoni peptide (FMRFamide/neurokinin-3)-like receptor 0.004 0.0226 0.0927
Schistosoma mansoni hypothetical protein 0.004 0.0226 0.0927
Schistosoma mansoni neuropeptide f receptor 76f 0.004 0.0226 0.0927
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799
Schistosoma mansoni biogenic amine (dopamine) receptor 0.004 0.0226 0.0927
Schistosoma mansoni rhodopsin-like orphan GPCR 0.004 0.0226 0.0927
Brugia malayi putative neuropeptide receptor NPR1 0.004 0.0226 0.0927
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.007 0.1254 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0054 0.0713 0.5223
Loa Loa (eye worm) hypothetical protein 0.004 0.0226 0.1799

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference

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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