Detailed information for compound 1380135

Basic information

Technical information
  • TDR Targets ID: 1380135
  • Name: 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[2-methyl -1-(3-methylphenyl)benzimidazol-5-yl]methanon e
  • MW: 391.463 | Formula: C23H25N3O3
  • H donors: 0 H acceptors: 2 LogP: 3.27 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1cccc(c1)n1c(C)nc2c1ccc(c2)C(=O)N1CCC2(CC1)OCCO2
  • InChi: 1S/C23H25N3O3/c1-16-4-3-5-19(14-16)26-17(2)24-20-15-18(6-7-21(20)26)22(27)25-10-8-23(9-11-25)28-12-13-29-23/h3-7,14-15H,8-13H2,1-2H3
  • InChiKey: NPPNSFNYOKPSKR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[2-methyl-1-(3-methylphenyl)-5-benzimidazolyl]methanone
  • MLS000095931
  • SMR000031479
  • Oprea1_021137
  • ChemDiv2_008275
  • 8-{[2-methyl-1-(3-methylphenyl)-1H-benzimidazol-5-yl]carbonyl}-1,4-dioxa-8-azaspiro[4.5]decane

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens GNAS complex locus Starlite/ChEMBL No references
Homo sapiens APEX nuclease (multifunctional DNA repair enzyme) 1 Starlite/ChEMBL No references
Homo sapiens hydroxyprostaglandin dehydrogenase 15-(NAD) Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease 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
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative Get druggable targets OG5_126768 All targets in OG5_126768
Cryptosporidium parvum conserved hypothetical protein 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 japonicum ko:K10772 AP endonuclease 2, putative Get druggable targets OG5_126768 All targets in OG5_126768
Brugia malayi exodeoxyribonuclease III family protein 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
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 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
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 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
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 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
Trichomonas vaginalis ap endonuclease, 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
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Leishmania infantum apurinic/apyrimidinic endonuclease-redox protein 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
Wolbachia endosymbiont of Brugia malayi exonuclease III 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
Trypanosoma congolense apurinic/apyrimidinic endonuclease, 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
Trypanosoma brucei gambiense apurinic/apyrimidinic endonuclease, 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
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 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
Neospora caninum hypothetical protein 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
Treponema pallidum exodeoxyribonuclease (exoA) 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
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 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
Schistosoma mansoni ap endonuclease 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
Leishmania mexicana apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease 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
Candida albicans similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Schistosoma mansoni ap endonuclease 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
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
Entamoeba histolytica exodeoxyribonuclease III, putative 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
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
Trypanosoma cruzi apurinic/apyrimidinic endonuclease Get druggable targets OG5_126768 All targets in OG5_126768
Theileria parva hypothetical protein 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
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum steroid dehydrogenase, putative hydroxyprostaglandin dehydrogenase 15-(NAD) 266 aa 216 aa 22.2 %
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0019 0.2118 0.2118
Brugia malayi ecdysteroid receptor 0.0019 0.2118 0.2118
Loa Loa (eye worm) steroid hormone receptor 0.0019 0.2118 0.2118
Echinococcus multilocularis ecdysone induced protein 78C 0.0019 0.2118 0.2118
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0227 0.0227
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 1 1
Schistosoma mansoni thyroid hormone receptor 0.0019 0.2118 0.2118
Schistosoma mansoni steroid hormone receptor ad4bp 0.0019 0.2118 0.2118
Schistosoma mansoni ap endonuclease 0.0023 0.2998 0.2998
Brugia malayi nuclear receptor RXR 0.001 0.0227 0.0227
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0019 0.2118 0.2118
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 1 1
Entamoeba histolytica hypothetical protein 0.0038 0.6265 1
Brugia malayi nuclear hormone receptor 0.0019 0.2118 0.2118
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.2998 0.5
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.001 0.0227 0.0227
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0019 0.2118 0.2118
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0019 0.2118 0.2118
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0019 0.2118 0.2118
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.2998 0.5
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0019 0.2118 0.2118
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0019 0.2118 0.2118
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0019 0.2118 0.2118
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0019 0.2118 0.2118
Brugia malayi photoreceptor-specific nuclear receptor 0.0019 0.2118 0.2118
Onchocerca volvulus Protein ultraspiracle homolog 0.0019 0.2118 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0019 0.2118 0.2118
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0019 0.2118 1
Brugia malayi Cytochrome P450 family protein 0.0024 0.3237 0.3237
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0019 0.2118 0.2118
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0019 0.2118 0.2118
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.2998 0.2998
Loa Loa (eye worm) hypothetical protein 0.001 0.0227 0.0227
Brugia malayi Nuclear hormone receptor-like 1 0.001 0.0227 0.0227
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0019 0.2118 0.2118
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0019 0.2118 0.2118
Schistosoma mansoni thyroid hormone receptor 0.0019 0.2118 0.2118
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.2998 0.5
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0227 0.0227
Loa Loa (eye worm) hypothetical protein 0.0019 0.2118 0.2118
Loa Loa (eye worm) hypothetical protein 0.0019 0.2118 0.2118
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0019 0.2118 0.2118
Brugia malayi steroid hormone receptor 0.0019 0.2118 0.2118
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.001 0.0227 0.0227
Loa Loa (eye worm) hypothetical protein 0.0019 0.2118 0.2118
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0019 0.2118 0.2118
Brugia malayi hypothetical protein 0.001 0.0227 0.0227
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.2998 0.2998
Echinococcus granulosus FTZ F1 alpha 0.0019 0.2118 0.2118
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0019 0.2118 0.2118
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0019 0.2118 0.2118
Loa Loa (eye worm) hypothetical protein 0.001 0.0227 0.0227
Brugia malayi hypothetical protein 0.001 0.0227 0.0227
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.2998 0.5
Echinococcus granulosus ecdysone induced protein 78C 0.0019 0.2118 0.2118
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.2998 0.5
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0019 0.2118 0.2118
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.2998 0.5
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0019 0.2118 0.2118
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.6265 0.6265
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0019 0.2118 0.2118
Entamoeba histolytica hypothetical protein 0.0038 0.6265 1
Onchocerca volvulus Bile acid receptor homolog 0.0019 0.2118 1
Schistosoma mansoni nuclear hormone receptor 0.0019 0.2118 0.2118
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.001 0.0227 0.0227
Schistosoma mansoni coup transcription factor 0.0019 0.2118 0.2118
Loa Loa (eye worm) hypothetical protein 0.0019 0.2118 0.2118
Brugia malayi nuclear receptor NHR-88 0.0019 0.2118 0.2118
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 1 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0019 0.2118 0.2118
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0019 0.2118 0.2118
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0019 0.2118 0.2118
Echinococcus multilocularis thyroid hormone receptor alpha 0.0019 0.2118 0.2118
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0019 0.2118 0.2118
Onchocerca volvulus 0.0019 0.2118 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 1 1
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.6265 0.6265
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.0019 0.2118 0.2118
Schistosoma mansoni retinoic acid receptor RXR 0.0019 0.2118 0.2118
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.2998 0.5
Entamoeba histolytica hypothetical protein 0.0038 0.6265 1
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.2998 0.5
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.2998 0.2998
Schistosoma mansoni ap endonuclease 0.0023 0.2998 0.2998
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0019 0.2118 0.2118
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0019 0.2118 0.2118
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 1 1
Entamoeba histolytica hypothetical protein 0.0038 0.6265 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0019 0.2118 0.2118
Loa Loa (eye worm) hypothetical protein 0.0019 0.2118 0.2118
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0019 0.2118 0.2118
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.2998 0.5
Echinococcus multilocularis FTZ F1 alpha 0.0019 0.2118 0.2118
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0019 0.2118 0.2118
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0019 0.2118 0.2118
Loa Loa (eye worm) hypothetical protein 0.0019 0.2118 0.2118
Schistosoma mansoni hypothetical protein 0.0038 0.6265 0.6265
Brugia malayi hypothetical protein 0.0038 0.6265 0.6265
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.001 0.0227 0.0227
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0019 0.2118 0.2118
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.2998 0.5
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0019 0.2118 0.2118
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0019 0.2118 0.2118
Loa Loa (eye worm) hypothetical protein 0.001 0.0227 0.0227
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0019 0.2118 0.2118
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.2998 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.0227 0.0227
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0019 0.2118 0.2118
Loa Loa (eye worm) hypothetical protein 0.0019 0.2118 0.2118
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0019 0.2118 0.2118
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0019 0.2118 0.2118
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0019 0.2118 0.2118
Brugia malayi Steroid receptor seven-up type 2 0.0019 0.2118 0.2118
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.2998 0.2998
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.2998 0.5
Loa Loa (eye worm) hypothetical protein 0.0019 0.2118 0.2118
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.2998 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.0227 0.0227
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.6265 0.6265
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 1 1
Loa Loa (eye worm) cytochrome P450 family protein 0.0024 0.3237 0.3237
Toxoplasma gondii exonuclease III APE 0.0023 0.2998 0.5
Schistosoma mansoni RAR-like nuclear receptor 0.0019 0.2118 0.2118

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 0.2512 uM PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 9.285 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] 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
Potency (functional) = 14.1254 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] ChEMBL. No reference
Potency (functional) 18.3489 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 29.0929 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS for Inhibitors of Vif-A3G Interactions: qHTS. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS for induction of synthetic lethality in tumor cells producing 2HG: qHTS for the HT-1080-NT fibrosarcoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 39.8107 um PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] ChEMBL. No reference
Potency (functional) 84.9214 uM PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Homo sapiens ChEMBL23
Plasmodium falciparum ChEMBL23

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.