Detailed information for compound 667997

Basic information

Technical information
  • TDR Targets ID: 667997
  • Name: N-(2-adamantyl)-3-chloro-4-ethoxybenzamide
  • MW: 333.852 | Formula: C19H24ClNO2
  • H donors: 1 H acceptors: 1 LogP: 4.55 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccc(cc1Cl)C(=O)NC1C2CC3CC1CC(C2)C3
  • InChi: 1S/C19H24ClNO2/c1-2-23-17-4-3-13(10-16(17)20)19(22)21-18-14-6-11-5-12(8-14)9-15(18)7-11/h3-4,10-12,14-15,18H,2,5-9H2,1H3,(H,21,22)
  • InChiKey: QRAUZNVNWXERDL-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-(2-adamantyl)-3-chloro-4-ethoxy-benzamide
  • ZINC00470956
  • STK240595

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
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0347 0.5
Plasmodium falciparum ataxin-2 like protein, putative 0.0027 0.0347 0.5
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0292 1 1
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0138 0.44 0.4198
Brugia malayi beta-lactamase family protein 0.0036 0.0688 0.0887
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1753 0.2271
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0041 0.0863 0.0534
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0106 0.3225 0.359
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0071 0.194 0.2669
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.1753 0.2261
Echinococcus granulosus geminin 0.0165 0.5377 0.6636
Echinococcus granulosus survival motor neuron protein 1 0.023 0.7753 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0688 0.046
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0106 0.3225 0.541
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0688 0.0353
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0978 0.041
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0138 0.44 0.4198
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0106 0.3225 0.541
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1753 0.2271
Loa Loa (eye worm) TAR-binding protein 0.0065 0.1753 0.1898
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1753 0.2271
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0978 0.041
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0071 0.194 1
Trypanosoma brucei hypothetical protein, conserved 0.0036 0.0688 0.0353
Toxoplasma gondii ABC1 family protein 0.0036 0.0688 0.1185
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1753 0.2271
Loa Loa (eye worm) hypothetical protein 0.0036 0.0688 0.046
Brugia malayi TAR-binding protein 0.0065 0.1753 0.2261
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0106 0.3225 0.359
Brugia malayi beta-lactamase 0.0036 0.0688 0.0887
Schistosoma mansoni hypothetical protein 0.0165 0.5377 1
Onchocerca volvulus 0.0047 0.1078 0.0712
Plasmodium vivax hypothetical protein, conserved 0.0036 0.0688 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0688 0.046
Brugia malayi beta-lactamase family protein 0.0036 0.0688 0.0887
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.005 0.119 0.0873
Loa Loa (eye worm) hypothetical protein 0.0071 0.194 0.215
Loa Loa (eye worm) RNA binding protein 0.0065 0.1753 0.1898
Loa Loa (eye worm) beta-lactamase 0.0036 0.0688 0.046
Loa Loa (eye worm) hypothetical protein 0.0036 0.0688 0.046
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.1753 0.1898
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0041 0.0863 0.0534
Loa Loa (eye worm) hypothetical protein 0.023 0.7753 1
Mycobacterium ulcerans hypothetical protein 0.0154 0.4968 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0138 0.44 0.4198
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0292 1 1
Loa Loa (eye worm) hypothetical protein 0.0187 0.6165 0.7856
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0978 0.0619
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0106 0.3225 0.541
Brugia malayi hypothetical protein 0.0027 0.0347 0.0448
Schistosoma mansoni hypothetical protein 0.0047 0.1078 0.0832
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0292 1 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0688 0.046
Leishmania major hypothetical protein, conserved 0.0036 0.0688 0.0353
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0044 0.0978 0.1261
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0978 0.0619
Echinococcus multilocularis tar DNA binding protein 0.0065 0.1753 0.1507
Brugia malayi N-terminal motif family protein 0.0187 0.6165 0.7952
Schistosoma mansoni survival motor neuron protein 0.0047 0.1078 0.0832
Brugia malayi Melibiase family protein 0.0071 0.194 0.2502
Echinococcus multilocularis geminin 0.0165 0.5377 0.6636
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0044 0.0978 0.0619
Schistosoma mansoni tar DNA-binding protein 0.0065 0.1753 0.2271
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0106 0.3225 0.541
Echinococcus granulosus tar DNA binding protein 0.0065 0.1753 0.1507
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.0863 0.0534
Mycobacterium leprae Probable lipase LipE 0.0036 0.0688 0.5
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0044 0.0978 0.0852
Echinococcus multilocularis survival motor neuron protein 1 0.023 0.7753 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0231 0.7803 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.0154 0.4968 0.6016
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.1078 0.139
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0044 0.0978 0.041
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0036 0.0688 0.046
Trypanosoma cruzi hypothetical protein, conserved 0.0036 0.0688 0.0353
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0071 0.194 0.2669
Mycobacterium leprae conserved hypothetical protein 0.0036 0.0688 0.5
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0036 0.0688 0.0887
Schistosoma mansoni hypothetical protein 0.0165 0.5377 1
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0106 0.3225 0.359
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.0863 0.0534
Brugia malayi hypothetical protein 0.023 0.7753 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0044 0.0978 0.041
Loa Loa (eye worm) hypothetical protein 0.0036 0.0688 0.046
Toxoplasma gondii hypothetical protein 0.0047 0.1083 0.2556
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0187 0.6165 1
Brugia malayi RNA binding protein 0.0065 0.1753 0.2261
Toxoplasma gondii melibiase subfamily protein 0.0106 0.3225 1

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.

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