Detailed information for compound 1407898

Basic information

Technical information
  • TDR Targets ID: 1407898
  • Name: 2-(2-chloro-6-fluorophenyl)-N-(4-methylpyridi n-2-yl)acetamide
  • MW: 278.709 | Formula: C14H12ClFN2O
  • H donors: 1 H acceptors: 2 LogP: 3.05 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Cc1c(F)cccc1Cl)Nc1nccc(c1)C
  • InChi: 1S/C14H12ClFN2O/c1-9-5-6-17-13(7-9)18-14(19)8-10-11(15)3-2-4-12(10)16/h2-7H,8H2,1H3,(H,17,18,19)
  • InChiKey: GSEUSXXCZYNKJG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-(2-chloro-6-fluoro-phenyl)-N-(4-methyl-2-pyridyl)acetamide
  • 2-(2-chloro-6-fluorophenyl)-N-(4-methyl-2-pyridyl)acetamide
  • 2-(2-chloro-6-fluoro-phenyl)-N-(4-methylpyridin-2-yl)ethanamide
  • BAS 09534905
  • ST5287084
  • Oprea1_719113
  • 2-(2-Chloro-6-fluoro-phenyl)-N-(4-methyl-pyridin-2-yl)-acetamide
  • AK-968/41018608

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references
Equus caballus Ferritin light chain Starlite/ChEMBL No references
Homo sapiens Werner syndrome, RecQ helicase-like Starlite/ChEMBL No references
Mus musculus RAR-related orphan receptor gamma Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Cryptosporidium parvum RecQ bloom helicase (RNA helicase+hrdc) Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum Bloom syndrome protein homolog, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium vivax ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania braziliensis ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Theileria parva hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Neospora caninum hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Entamoeba histolytica recQ family helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis bloom syndrome protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Cryptosporidium hominis DEAD/DEAH box helicase Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Plasmodium yoelii ATP-dependent DNA helicase recQ-related Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus multilocularis ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi Bloom's syndrome protein homolog Get druggable targets OG5_126644 All targets in OG5_126644
Trichomonas vaginalis DNA helicase recq, putative Get druggable targets OG5_126644 All targets in OG5_126644
Candida albicans DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) RecQ helicase Get druggable targets OG5_126644 All targets in OG5_126644
Babesia bovis ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma brucei gambiense ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma japonicum ko:K03654 ATP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium yoelii ATP-dependent DNA helicase-related Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania infantum ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania donovani ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi ATP-dependent DNA helicase, RecQ family protein Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium knowlesi ADP-dependent DNA helicase RecQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Treponema pallidum ATP-dependent DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania mexicana ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium berghei ATP-dependent DNA helicase Q1, putative Get druggable targets OG5_126644 All targets in OG5_126644
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma mansoni blooms syndrome DNA helicase Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ADP-dependent DNA helicase RecQ Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq1 Get druggable targets OG5_126644 All targets in OG5_126644
Plasmodium falciparum ATP-dependent DNA helicase Q1 Get druggable targets OG5_126644 All targets in OG5_126644
Giardia lamblia Sgs1 DNA helicase, putative Get druggable targets OG5_126644 All targets in OG5_126644
Schistosoma mansoni DNA helicase recq5 Get druggable targets OG5_126644 All targets in OG5_126644
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative Get druggable targets OG5_126644 All targets in OG5_126644
Echinococcus granulosus ATP dependent DNA helicase Q5 Get druggable targets OG5_126644 All targets in OG5_126644
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 %
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 146 aa 28.8 %
Echinococcus multilocularis expressed protein Ferritin light chain   175 aa 146 aa 30.1 %
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 %
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis Smad4 0.001 0.0165 0.0149
Schistosoma mansoni ferritin light chain 0.001 0.0183 0.0183
Echinococcus granulosus bloom syndrome protein 0.0029 0.1012 0.0998
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0012 0.027 0.0255
Echinococcus multilocularis smad 0.001 0.0165 0.0149
Brugia malayi nuclear receptor NHR-88 0.0012 0.027 0.0255
Schistosoma mansoni smad1 5 8 and 0.001 0.0165 0.0165
Entamoeba histolytica recQ family helicase, putative 0.0015 0.0415 0.4531
Brugia malayi steroid hormone receptor 0.0012 0.027 0.0255
Loa Loa (eye worm) hypothetical protein 0.0012 0.027 0.0255
Echinococcus granulosus smad 0.001 0.0165 0.0149
Mycobacterium leprae PROBABLE BACTERIOFERRITIN BFRA 0.001 0.0183 0.5
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0012 0.027 0.0255
Mycobacterium tuberculosis Bacterioferritin BfrB 0.001 0.0183 0.5
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0006 0.0015 0.0015
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0259 0.2832
Mycobacterium tuberculosis Probable bacterioferritin BfrA 0.001 0.0183 0.5
Brugia malayi ecdysteroid receptor 0.0012 0.027 0.0255
Echinococcus granulosus FTZ F1 alpha 0.0012 0.027 0.0255
Echinococcus granulosus TGF beta signal transducer SmadC 0.001 0.0165 0.0149
Loa Loa (eye worm) RecQ helicase 0.0029 0.1012 0.0998
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0012 0.027 0.0255
Echinococcus granulosus mothers against decapentaplegic 5 0.001 0.0165 0.0149
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0012 0.027 0.027
Loa Loa (eye worm) kinesin-like protein KLP2 0.0027 0.0916 0.0902
Trichomonas vaginalis DNA helicase recq, putative 0.0015 0.0415 0.2799
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0012 0.027 0.0255
Echinococcus multilocularis ferritin 0.001 0.0183 0.0168
Echinococcus multilocularis ATP dependent DNA helicase Q5 0.0012 0.0259 0.0244
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.027 0.0255
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.027 0.0255
Echinococcus multilocularis bloom syndrome protein 0.0029 0.1012 0.0998
Brugia malayi nuclear hormone receptor 0.0012 0.027 0.0255
Brugia malayi MH2 domain containing protein 0.001 0.0165 0.0149
Schistosoma mansoni TGF-beta signal transducer Smad2 0.001 0.0165 0.0165
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0012 0.027 0.0255
Schistosoma mansoni apoferritin-2 0.001 0.0183 0.0183
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0012 0.027 0.0255
Schistosoma mansoni coup transcription factor 0.0012 0.027 0.027
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.027 0.0255
Brugia malayi Steroid receptor seven-up type 2 0.0012 0.027 0.0255
Brugia malayi MH1 domain containing protein 0.001 0.0165 0.0149
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0012 0.027 0.0255
Schistosoma mansoni smad1 5 8 and 0.001 0.0165 0.0165
Echinococcus granulosus expressed protein 0.001 0.0183 0.0168
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0012 0.027 0.0255
Echinococcus multilocularis ecdysone induced protein 78C 0.0012 0.027 0.0255
Schistosoma mansoni Smad4 0.001 0.0165 0.0165
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0012 0.027 0.0255
Trypanosoma cruzi ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0415 0.5
Schistosoma mansoni DNA helicase recq1 0.0012 0.0259 0.0259
Echinococcus multilocularis TGF beta signal transducer SmadC 0.001 0.0165 0.0149
Loa Loa (eye worm) hypothetical protein 0.0012 0.027 0.0255
Schistosoma mansoni ferritin light chain 0.001 0.0183 0.0183
Plasmodium falciparum kinesin-5 0.0027 0.0916 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0012 0.027 0.0255
Schistosoma mansoni ferritin 0.001 0.0183 0.0183
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0012 0.027 0.027
Brugia malayi MH2 domain containing protein 0.0144 0.6106 0.61
Giardia lamblia Kinesin-5 0.0027 0.0916 1
Schistosoma mansoni retinoic acid receptor RXR 0.0012 0.027 0.027
Loa Loa (eye worm) hypothetical protein 0.0012 0.027 0.0255
Loa Loa (eye worm) hypothetical protein 0.0012 0.027 0.0255
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0012 0.027 0.0255
Loa Loa (eye worm) Smad1 0.001 0.0165 0.0149
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0012 0.027 0.0255
Schistosoma mansoni thyroid hormone receptor 0.0012 0.027 0.027
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0006 0.0015 0.0015
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0012 0.027 0.027
Schistosoma mansoni ferritin 0.001 0.0183 0.0183
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.027 0.0255
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0259 0.0244
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0012 0.027 0.0255
Treponema pallidum bacterioferrin (TpF1) 0.001 0.0183 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0012 0.027 0.0255
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0012 0.027 0.027
Echinococcus granulosus ATP dependent DNA helicase Q5 0.0012 0.0259 0.0244
Toxoplasma gondii kinesin motor domain-containing protein 0.0027 0.0916 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0012 0.027 0.0255
Schistosoma mansoni blooms syndrome DNA helicase 0.0023 0.0743 0.0743
Loa Loa (eye worm) hypothetical protein 0.0012 0.027 0.0255
Loa Loa (eye worm) hypothetical protein 0.0012 0.027 0.0255
Loa Loa (eye worm) MH1 domain-containing protein 0.001 0.0165 0.0149
Plasmodium falciparum ADP-dependent DNA helicase RecQ 0.0025 0.0857 0.9092
Brugia malayi Kinesin motor domain containing protein 0.0027 0.0916 0.0902
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0012 0.027 0.0255
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0012 0.027 0.0255
Loa Loa (eye worm) steroid hormone receptor 0.0012 0.027 0.0255
Echinococcus multilocularis kinesin family 1 0.0206 0.8859 0.8857
Echinococcus multilocularis ATP dependent DNA helicase Q1 0.0012 0.0259 0.0244
Brugia malayi MH2 domain containing protein 0.001 0.0165 0.0149
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.6106 0.61
Schistosoma mansoni smad 0.001 0.0165 0.0165
Echinococcus granulosus Smad4 0.001 0.0165 0.0149
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.027 0.0255
Loa Loa (eye worm) hypothetical protein 0.0012 0.0259 0.0244
Loa Loa (eye worm) hypothetical protein 0.0012 0.027 0.0255
Loa Loa (eye worm) hypothetical protein 0.0012 0.027 0.0255
Loa Loa (eye worm) MH2 domain-containing protein 0.001 0.0165 0.0149
Schistosoma mansoni ferritin 0.001 0.0183 0.0183
Brugia malayi MH1 domain containing protein 0.001 0.0165 0.0149
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0012 0.027 0.0255
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0012 0.027 0.0255
Echinococcus multilocularis FTZ F1 alpha 0.0012 0.027 0.0255
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.001 0.0183 0.5
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0012 0.027 0.027
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0259 0.2832
Echinococcus multilocularis mothers against decapentaplegic 5 0.001 0.0165 0.0149
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0012 0.027 0.0255
Mycobacterium ulcerans bacterioferritin BfrA 0.001 0.0183 0.5
Schistosoma mansoni nuclear hormone receptor 0.0012 0.027 0.027
Schistosoma mansoni RAR-like nuclear receptor 0.0012 0.027 0.027
Echinococcus granulosus ecdysone induced protein 78C 0.0012 0.027 0.0255
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0012 0.027 0.0255
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0012 0.027 0.0255
Brugia malayi Nuclear hormone receptor-like 1 0.0012 0.027 0.0255
Schistosoma mansoni DNA helicase recq5 0.0012 0.0259 0.0259
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.6106 0.61
Echinococcus granulosus ATP dependent DNA helicase Q1 0.0012 0.0259 0.0244
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0012 0.027 0.0255
Schistosoma mansoni hypothetical protein 0.018 0.7673 0.7673
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0012 0.027 0.0255
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0012 0.027 0.027
Toxoplasma gondii ATP-dependent DNA helicase, RecQ family protein 0.0019 0.0587 0.6405
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0012 0.027 0.0255
Brugia malayi ATP-dependent DNA helicase, RecQ family protein 0.0012 0.0259 0.0244
Echinococcus multilocularis thyroid hormone receptor alpha 0.0012 0.027 0.0255
Echinococcus multilocularis expressed protein 0.001 0.0183 0.0168
Loa Loa (eye worm) hypothetical protein 0.0146 0.6183 0.6178
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0012 0.027 0.0255
Brugia malayi Bloom's syndrome protein homolog 0.0029 0.1012 0.0998
Echinococcus granulosus kinesin family 1 0.0206 0.8859 0.8857
Entamoeba histolytica kinesin, putative 0.0027 0.0916 1
Schistosoma mansoni thyroid hormone receptor 0.0012 0.027 0.027
Trichomonas vaginalis DNA helicase recq1, putative 0.0029 0.1012 1
Schistosoma mansoni smad1 5 8 and 0.001 0.0165 0.0165
Brugia malayi Smad1 0.001 0.0165 0.0149
Brugia malayi photoreceptor-specific nuclear receptor 0.0012 0.027 0.0255
Leishmania major ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0415 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0012 0.027 0.0255
Mycobacterium ulcerans bacterioferritin BfrB 0.001 0.0183 0.5
Schistosoma mansoni ferritin 0.001 0.0183 0.0183
Loa Loa (eye worm) ATP-dependent DNA helicase 0.0012 0.0259 0.0244
Schistosoma mansoni steroid hormone receptor ad4bp 0.0012 0.027 0.027
Schistosoma mansoni apoferritin-2 0.001 0.0183 0.0183
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0012 0.027 0.0255
Plasmodium vivax kinesin-5 0.0027 0.0916 1
Schistosoma mansoni kinesin eg-5 0.0027 0.0916 0.0916
Trichomonas vaginalis DNA helicase recq, putative 0.0029 0.1012 1
Trypanosoma brucei ATP-dependent DEAD/H DNA helicase recQ, putative 0.0015 0.0415 0.5
Echinococcus granulosus ferritin 0.001 0.0183 0.0168

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.631 um PUBCHEM_BIOASSAY: qHTS for inhibitors of ROR gamma transcriptional activity. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 3.2944 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS for Inhibitors of WRN Helicase. (Class of assay: confirmatory) ChEMBL. No reference
Potency (binding) = 17.7828 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) 17.7828 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] ChEMBL. No reference
Potency (functional) 18.526 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) 28.1838 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
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.

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