Detailed information for compound 1421009

Basic information

Technical information
  • TDR Targets ID: 1421009
  • Name: 2-ethoxy-N-[9-(phenylmethyl)-9-azabicyclo[3.3 .1]nonan-7-yl]benzamide
  • MW: 378.507 | Formula: C24H30N2O2
  • H donors: 1 H acceptors: 1 LogP: 4.6 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1ccccc1C(=O)NC1CC2CCCC(C1)N2Cc1ccccc1
  • InChi: 1S/C24H30N2O2/c1-2-28-23-14-7-6-13-22(23)24(27)25-19-15-20-11-8-12-21(16-19)26(20)17-18-9-4-3-5-10-18/h3-7,9-10,13-14,19-21H,2,8,11-12,15-17H2,1H3,(H,25,27)
  • InChiKey: GFCXINFWTLYCDS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[9-(benzyl)-9-azabicyclo[3.3.1]nonan-7-yl]-2-ethoxy-benzamide
  • MLS000122083
  • SMR000119442
  • ASN 06223686
  • N-(9-Benzyl-9-aza-bicyclo[3.3.1]non-3-yl)-2-ethoxy-benzamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Equus caballus Ferritin light chain Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Brugia malayi exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Cryptosporidium parvum conserved hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania major apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA Get druggable targets OG5_126768 All targets in OG5_126768
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma congolense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania braziliensis apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10771 AP endonuclease 1, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni ap endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Trichomonas vaginalis ap endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium hominis dna-(apurinic or apyrimidinic site) lyase Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Toxoplasma gondii exonuclease III APE Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium berghei AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium yoelii putative AP endonuclease-related Get druggable targets OG5_126768 All targets in OG5_126768
Leishmania donovani apurinic/apyrimidinic endonuclease-redox protein Get druggable targets OG5_126768 All targets in OG5_126768
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Treponema pallidum exodeoxyribonuclease (exoA) Get druggable targets OG5_126768 All targets in OG5_126768
Neospora caninum hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Entamoeba histolytica exodeoxyribonuclease III, putative Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) Get druggable targets OG5_126768 All targets in OG5_126768
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Theileria parva hypothetical protein Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Plasmodium knowlesi AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi exonuclease III Get druggable targets OG5_126768 All targets in OG5_126768
Loa Loa (eye worm) exodeoxyribonuclease III family protein Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma japonicum DNA-(apurinic or apyrimidinic site) lyase 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Giardia lamblia Endonuclease/Exonuclease/phosphatase Get druggable targets OG5_126768 All targets in OG5_126768
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative Get druggable targets OG5_126768 All targets in OG5_126768
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma japonicum Ferritin, putative Ferritin light chain   175 aa 144 aa 24.3 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
Echinococcus granulosus expressed protein Ferritin light chain   175 aa 146 aa 28.8 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 44.4 %
Schistosoma mansoni apoferritin-2 Ferritin light chain   175 aa 142 aa 29.6 %
Schistosoma mansoni ferritin Ferritin light chain   175 aa 171 aa 43.9 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0998 0.6158 0.5
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.0245 0.0245
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0018 0.0015 0.0036
Mycobacterium ulcerans cytochrome P450 143A3 Cyp143A3 0.0018 0.0015 0.0024
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0133 0.0732 1
Schistosoma mansoni hypothetical protein 0.051 0.3095 0.377
Mycobacterium ulcerans cytochrome P450 187A4 Cyp187A4 0.0018 0.0015 0.0024
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0133 0.0732 0.0892
Schistosoma mansoni hypothetical protein 0.1101 0.6804 0.8288
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0041 0.005
Schistosoma mansoni tar DNA-binding protein 0.086 0.529 0.6443
Brugia malayi cytochrome P450 0.0018 0.0015 0.0015
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0018 0.0015 0.0036
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0998 0.6158 1
Schistosoma mansoni ap endonuclease 0.0023 0.0041 0.005
Mycobacterium ulcerans cytochrome p450 150 cyp150 0.0018 0.0015 0.0024
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0207 0.1196 0.5
Brugia malayi Probable ClpP-like protease 0.0998 0.6158 0.6158
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.051 0.3095 0.377
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0041 0.0067
Schistosoma mansoni tar DNA-binding protein 0.086 0.529 0.6443
Echinococcus granulosus p2X purinoceptor 4 0.1325 0.821 1
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0133 0.0732 0.113
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0998 0.6158 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.051 0.3095 0.377
Loa Loa (eye worm) cytochrome P450 family protein 0.0028 0.0072 0.0072
Echinococcus granulosus p2X purinoceptor 4 0.1325 0.821 1
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0018 0.0015 0.0036
Mycobacterium ulcerans cytochrome P450 187A5 Cyp187A5 0.0018 0.0015 0.0024
Toxoplasma gondii isocitrate dehydrogenase 0.0133 0.0732 0.1169
Brugia malayi Isocitrate dehydrogenase 0.0133 0.0732 0.0732
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0018 0.0015 0.0036
Trypanosoma brucei cytochrome P450, putative 0.0028 0.0072 0.0799
Loa Loa (eye worm) RNA binding protein 0.086 0.529 0.529
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0018 0.0015 0.0036
Loa Loa (eye worm) CYP4Cod1 0.0028 0.0072 0.0072
Schistosoma mansoni hypothetical protein 0.0018 0.0015 0.0018
Schistosoma mansoni ap endonuclease 0.0023 0.0041 0.005
Mycobacterium leprae putative cytochrome p450 0.0018 0.0015 0.0024
Schistosoma mansoni tar DNA-binding protein 0.086 0.529 0.6443
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.086 0.529 0.529
Brugia malayi Cytochrome P450 family protein 0.0058 0.0264 0.0264
Echinococcus multilocularis peptidase Clp (S14 family) 0.0654 0.4001 0.4874
Echinococcus granulosus tar DNA binding protein 0.086 0.529 0.6443
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0133 0.0732 1
Toxoplasma gondii exonuclease III APE 0.0023 0.0041 0.0043
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0018 0.0015 0.0036
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0133 0.0732 0.183
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.0041 1
Brugia malayi Cytochrome P450 family protein 0.0028 0.0072 0.0072
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0998 0.6158 0.7501
Loa Loa (eye worm) isocitrate dehydrogenase 0.0133 0.0732 0.0732
Mycobacterium ulcerans cytochrome P450 144A4 Cyp144A4 0.0018 0.0015 0.0024
Mycobacterium leprae ATP-dependent Clp protease proteolytic subunit 1 0.0344 0.2055 0.3337
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0245 0.0299
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0998 0.6158 0.7501
Mycobacterium ulcerans cytochrome P450 142A3 Cyp142A3 0.0018 0.0015 0.0024
Schistosoma mansoni hypothetical protein 0.051 0.3095 0.377
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0245 0.0299
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.051 0.3095 0.3095
Leishmania major cytochrome p450-like protein 0.0028 0.0072 0.0981
Echinococcus granulosus peptidase Clp S14 family 0.0654 0.4001 0.4874
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0018 0.0015 0.0036
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0018 0.0015 0.0036
Loa Loa (eye worm) hypothetical protein 0.1101 0.6804 0.6804
Echinococcus granulosus p2X purinoceptor 4 0.1325 0.821 1
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0133 0.0732 0.0892
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0133 0.0732 0.0892
Leishmania major cytochrome p450-like protein 0.0018 0.0015 0.0198
Echinococcus multilocularis p2X purinoceptor 4 0.1325 0.821 1
Mycobacterium ulcerans cytochrome P450 189A7 Cyp189A7 0.0018 0.0015 0.0024
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0018 0.0015 0.0036
Mycobacterium ulcerans cytochrome P450 143A4 Cyp143A4 0.0018 0.0015 0.0024
Schistosoma mansoni tar DNA-binding protein 0.086 0.529 0.6443
Brugia malayi N-terminal motif family protein 0.0207 0.1196 0.1196
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0133 0.0732 0.0892
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0998 0.6158 1
Mycobacterium ulcerans cytochrome P450 105Q4 Cyp105Q4 0.0018 0.0015 0.0024
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0998 0.6158 1
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0041 0.0041
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0245 0.0299
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0041 0.0371
Echinococcus granulosus cytochrome P450 2K1 0.0018 0.0015 0.0018
Brugia malayi TAR-binding protein 0.086 0.529 0.529
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0018 0.0015 0.0036
Schistosoma mansoni P2X receptor subunit 0.1325 0.821 1
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0018 0.0015 0.0036
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0344 0.2055 0.3293
Echinococcus multilocularis GPCR, family 2 0.051 0.3095 0.377
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0654 0.4001 1
Mycobacterium leprae Conserved hypothetical protein 0.0018 0.0015 0.0024
Toxoplasma gondii hypothetical protein 0.0344 0.2055 0.3322
Loa Loa (eye worm) TAR-binding protein 0.086 0.529 0.529
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.051 0.3095 0.377
Mycobacterium ulcerans cytochrome P450 124A1, Cyp124A1 0.0018 0.0015 0.0024
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0018 0.0015 0.0036
Schistosoma mansoni P2X receptor subunit 0.1325 0.821 1
Brugia malayi Cytochrome P450 family protein 0.0028 0.0072 0.0072
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0018 0.0015 0.0036
Echinococcus multilocularis tar DNA binding protein 0.086 0.529 0.6443
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0998 0.6158 1
Loa Loa (eye worm) hypothetical protein 0.0998 0.6158 0.6158
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.051 0.3095 0.377
Brugia malayi Calcitonin receptor-like protein seb-1 0.1611 1 1
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0133 0.0732 1
Trypanosoma cruzi cytochrome P450, putative 0.0028 0.0072 0.0799
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0998 0.6158 1
Mycobacterium ulcerans cytochrome P450 136A2 Cyp136A2 0.0018 0.0015 0.0024
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0018 0.0015 0.0036
Toxoplasma gondii isocitrate dehydrogenase 0.0133 0.0732 0.1169
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0245 0.0299
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0018 0.0015 0.0036
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0998 0.6158 0.5
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0018 0.0015 0.0036
Brugia malayi Cytochrome P450 family protein 0.0018 0.0015 0.0015
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.0245 0.0299
Mycobacterium ulcerans cytochrome P450 126A3 Cyp126A3 0.0018 0.0015 0.0024
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0041 0.0562
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.0245 0.0299
Mycobacterium ulcerans cytochrome P450 150A6 Cyp150A6 0.0018 0.0015 0.0024
Loa Loa (eye worm) pigment dispersing factor receptor c 0.1611 1 1
Echinococcus multilocularis 0.0018 0.0015 0.0018
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.0041 0.5
Loa Loa (eye worm) cytochrome P450 family protein 0.0058 0.0264 0.0264
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0041 1
Loa Loa (eye worm) hypothetical protein 0.1611 1 1
Schistosoma mansoni hypothetical protein 0.051 0.3095 0.377
Echinococcus multilocularis p2X purinoceptor 4 0.1325 0.821 1
Brugia malayi latrophilin 2 splice variant baaae 0.1101 0.6804 0.6804
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0133 0.0732 0.113
Schistosoma mansoni tar DNA-binding protein 0.086 0.529 0.6443
Loa Loa (eye worm) cytochrome P450 0.0018 0.0015 0.0015
Echinococcus granulosus GPCR family 2 0.051 0.3095 0.377
Brugia malayi isocitrate dehydrogenase 0.0133 0.0732 0.0732
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0041 1
Loa Loa (eye worm) hypothetical protein 0.051 0.3095 0.3095
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0018 0.0015 0.0036
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0041 0.0371
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0998 0.6158 1
Trypanosoma cruzi cytochrome P450, putative 0.0028 0.0072 0.0799
Schistosoma mansoni P2X receptor subunit 0.1325 0.821 1
Mycobacterium ulcerans cytochrome P450 123A3 Cyp123A3 0.0018 0.0015 0.0024
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0041 0.0371
Mycobacterium ulcerans cytochrome P450 108B4 Cyp108B4 0.0018 0.0015 0.0024
Echinococcus multilocularis p2X purinoceptor 4 0.1325 0.821 1
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0133 0.0732 1
Schistosoma mansoni hypothetical protein 0.051 0.3095 0.377
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0654 0.4001 0.6498
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0041 0.0041
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0041 0.0067
Mycobacterium ulcerans cytochrome P450 188A3 Cyp188A3 0.0018 0.0015 0.0024
Mycobacterium ulcerans cytochrome P450 140A5 Cyp140A5 0.0018 0.0015 0.0024
Brugia malayi RNA recognition motif domain containing protein 0.086 0.529 0.529
Brugia malayi Latrophilin receptor protein 2 0.051 0.3095 0.3095
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0018 0.0015 0.0036
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0133 0.0732 0.0892
Schistosoma mansoni cytochrome P450 0.0018 0.0015 0.0018
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0998 0.6158 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.0245 0.0299
Mycobacterium ulcerans cytochrome P450 125A7 Cyp125A7 0.0018 0.0015 0.0024
Mycobacterium ulcerans cytochrome P450 51B1 Cyp51B1 0.0018 0.0015 0.0024
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0133 0.0732 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.051 0.3095 0.3095
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0998 0.6158 1
Leishmania major cytochrome p450-like protein 0.0018 0.0015 0.0198
Mycobacterium ulcerans cytochrome P450 191A3 Cyp191A3 0.0018 0.0015 0.0024
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0018 0.0015 0.0036
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0018 0.0015 0.0036
Echinococcus multilocularis isocitrate dehydrogenase 0.0133 0.0732 0.0892
Loa Loa (eye worm) cytochrome P450 family protein 0.0028 0.0072 0.0072
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.0041 0.0103
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0133 0.0732 0.0892
Brugia malayi RNA binding protein 0.086 0.529 0.529
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.0245 0.0245
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0028 0.0072 0.0117
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0344 0.2055 0.3293
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0344 0.2055 0.3293
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0654 0.4001 1
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0041 0.005
Leishmania major lanosterol 14-alpha-demethylase, putative 0.0018 0.0015 0.0198
Schistosoma mansoni P2X receptor subunit 0.1325 0.821 1
Loa Loa (eye worm) hypothetical protein 0.0207 0.1196 0.1196
Schistosoma mansoni peptidase Clp (S14 family) 0.0998 0.6158 0.7501

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.0011 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 8.9125 um PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (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.

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