Detailed information for compound 1571839

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 588.118 | Formula: C28H34ClN5O5S
  • H donors: 1 H acceptors: 5 LogP: 3.72 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 2
  • SMILES: CC(C1C(=O)N(CC[S+](=O)(N1Cc1ccc(cc1)c1ccccc1Cl)[O-])Cc1nnn(c1)CCC1OCCO1)C
  • InChi: 1S/C28H34ClN5O5S/c1-20(2)27-28(35)32(18-23-19-33(31-30-23)12-11-26-38-14-15-39-26)13-16-40(36,37)34(27)17-21-7-9-22(10-8-21)24-5-3-4-6-25(24)29/h3-10,19-20,26-27H,11-18H2,1-2H3
  • InChiKey: OKUSJGKWUDNQKJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens parathyroid hormone 1 receptor Starlite/ChEMBL No references
Homo sapiens glucagon-like peptide 1 receptor Starlite/ChEMBL No references
Homo sapiens isocitrate dehydrogenase 1 (NADP+), soluble Starlite/ChEMBL No references
Homo sapiens SMAD family member 2 Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Candida albicans C terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial Get druggable targets OG5_127057 All targets in OG5_127057
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei gambiense isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum Isocitrate dehydrogenase-like protein, related Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium knowlesi isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum ko:K00031 isocitrate dehydrogenase [EC1.1.1.42], putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania braziliensis isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium berghei isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi MH2 domain containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) MH2 domain-containing protein Get druggable targets OG5_131716 All targets in OG5_131716
Schistosoma mansoni NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) Get druggable targets OG5_127057 All targets in OG5_127057
Neospora caninum hypothetical protein Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent, putative Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans N terminus of cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania infantum isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Brugia malayi Isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Babesia bovis isocitrate dehydrogenase, NADP-dependent family protein Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans Mitochondrial NADP-specific isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Loa Loa (eye worm) transcription factor SMAD2 Get druggable targets OG5_131716 All targets in OG5_131716
Brugia malayi isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Plasmodium yoelii isocitrate dehydrogenase, NADP-dependent Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Theileria parva isocitrate dehydrogenase (NADP+), putative Get druggable targets OG5_127057 All targets in OG5_127057
Toxoplasma gondii isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Candida albicans cytosolic NADP-specific isocitrate dehydrogenase. Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Schistosoma japonicum ko:K04588 secretin receptor, putative Get druggable targets OG5_139196 All targets in OG5_139196
Trypanosoma congolense isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma brucei isocitrate dehydrogenase, putative Get druggable targets OG5_127057 All targets in OG5_127057
Echinococcus granulosus NADP dependent isocitrate dehydrogenase Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania donovani isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
Leishmania mexicana isocitrate dehydrogenase [NADP], mitochondrial precursor, putative Get druggable targets OG5_127057 All targets in OG5_127057
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi MH2 domain containing protein SMAD family member 2 467 aa 405 aa 31.6 %
Loa Loa (eye worm) pigment dispersing factor receptor c glucagon-like peptide 1 receptor 463 aa 388 aa 25.8 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Nuclear hormone receptor E75 0.0106 0.4229 0.4229
Schistosoma mansoni hypothetical protein 0.0038 0.0922 0.0922
Brugia malayi steroid hormone receptor 0.0225 1 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0225 1 1
Loa Loa (eye worm) nuclear receptor NHR-67 0.0106 0.4229 0.4229
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0106 0.4229 0.4229
Schistosoma mansoni RAR-like nuclear receptor 0.0225 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0225 1 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0225 1 1
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0225 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0225 1 1
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0038 0.0922 0.0922
Echinococcus granulosus nuclear receptor nhr 48 0.0106 0.4229 0.4229
Loa Loa (eye worm) pigment dispersing factor receptor c 0.012 0.491 0.491
Onchocerca volvulus 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0038 0.0922 0.0922
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0225 1 1
Brugia malayi hypothetical protein 0.0106 0.4229 0.4229
Brugia malayi Nuclear hormone receptor-like 1 0.0119 0.4847 0.4847
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.012 0.491 0.491
Echinococcus granulosus Nuclear hormone receptor HR96 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0119 0.4847 0.4847
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0019 0 0.5
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0225 1 1
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0225 1 1
Schistosoma mansoni hypothetical protein 0.0038 0.0922 0.0922
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0038 0.0922 0.0922
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0106 0.4229 0.4229
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0225 1 1
Brugia malayi tailless protein 0.0106 0.4229 0.4229
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0019 0 0.5
Schistosoma mansoni thyroid hormone receptor 0.0225 1 1
Brugia malayi nuclear receptor RXR 0.0106 0.4229 0.4229
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0225 1 1
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0106 0.4229 0.4229
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0225 1 1
Brugia malayi photoreceptor-specific nuclear receptor 0.0225 1 1
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0119 0.4847 0.4847
Schistosoma mansoni nuclear receptor 0.0106 0.4229 0.4229
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0038 0.0922 0.0922
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.4847 0.4847
Loa Loa (eye worm) hypothetical protein 0.0119 0.4847 0.4847
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0225 1 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0225 1 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Schistosoma mansoni nuclear hormone receptor 0.0225 1 1
Schistosoma mansoni nuclear receptor 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0225 1 1
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0106 0.4229 0.4229
Brugia malayi Nuclear hormone receptor-like 1 0.0225 1 1
Loa Loa (eye worm) DR-78 0.0106 0.4229 0.4229
Brugia malayi nuclear hormone receptor 0.0106 0.4229 0.4229
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0225 1 1
Brugia malayi nuclear hormone receptor family member nhr-6 0.0106 0.4229 0.4229
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Schistosoma mansoni nuclear receptor nhr-48 0.0106 0.4229 0.4229
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0106 0.4229 0.4229
Brugia malayi hypothetical protein 0.0119 0.4847 0.4847
Echinococcus granulosus Nuclear hormone receptor HR96 0.0106 0.4229 0.4229
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0225 1 1
Onchocerca volvulus Protein ultraspiracle homolog 0.0225 1 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0119 0.4847 0.4847
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0019 0 0.5
Schistosoma mansoni retinoic acid receptor RXR 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Schistosoma mansoni nuclear hormone receptor 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Echinococcus multilocularis GPCR, family 2 0.0038 0.0922 0.0922
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0225 1 1
Echinococcus multilocularis ecdysone induced protein 78C 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0225 1 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0038 0.0922 0.0922
Echinococcus granulosus ecdysone induced protein 78C 0.0225 1 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0225 1 1
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0225 1 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0225 1 1
Brugia malayi latrophilin 2 splice variant baaae 0.0082 0.3064 0.3064
Schistosoma mansoni coup transcription factor 0.0225 1 1
Loa Loa (eye worm) latrophilin receptor protein 2 0.0038 0.0922 0.0922
Onchocerca volvulus Bile acid receptor homolog 0.0225 1 1
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0019 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0225 1 1
Echinococcus multilocularis FTZ F1 alpha 0.0225 1 1
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0 0.5
Brugia malayi nuclear receptor NHR-88 0.0225 1 1
Schistosoma mansoni hypothetical protein 0.0038 0.0922 0.0922
Brugia malayi Latrophilin receptor protein 2 0.0038 0.0922 0.0922
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0225 1 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.012 0.491 0.491
Brugia malayi Calcitonin receptor-like protein seb-1 0.012 0.491 0.491
Echinococcus granulosus GPCR family 2 0.0038 0.0922 0.0922
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0225 1 1
Schistosoma mansoni thyroid hormone receptor 0.0225 1 1
Brugia malayi nuclear hormone receptor family member odr-7 0.0106 0.4229 0.4229
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.6062 0.6062
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0225 1 1
Brugia malayi MH2 domain containing protein 0.0144 0.6062 0.6062
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0225 1 1
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0082 0.3064 0.3064
Brugia malayi hypothetical protein 0.0106 0.4229 0.4229
Brugia malayi nuclear hormone receptor 0.0225 1 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0225 1 1
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0225 1 1
Brugia malayi nuclear receptor NHR-88 0.0106 0.4229 0.4229
Brugia malayi orphan nuclear receptor NR2E1 0.0106 0.4229 0.4229
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0225 1 1
Schistosoma mansoni hypothetical protein 0.0038 0.0922 0.0922
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0119 0.4847 0.4847
Loa Loa (eye worm) hypothetical protein 0.0119 0.4847 0.4847
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0106 0.4229 0.4229
Brugia malayi nuclear receptor NHR-67 0.0106 0.4229 0.4229
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0225 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.4847 0.4847
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0225 1 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0225 1 1
Loa Loa (eye worm) nuclear hormone receptor 0.0106 0.4229 0.4229
Loa Loa (eye worm) steroid hormone receptor 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0106 0.4229 0.4229
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0225 1 1
Schistosoma mansoni zinc finger protein 0.0106 0.4229 0.4229
Brugia malayi nuclear receptor RXR 0.0119 0.4847 0.4847
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Brugia malayi conserved hypotetical protein 0.0106 0.4229 0.4229
Echinococcus granulosus FTZ F1 alpha 0.0225 1 1
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0225 1 1
Schistosoma mansoni nuclear hormone receptor 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0225 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.0119 0.4847 0.4847
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0038 0.0922 0.0922
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0225 1 1
Echinococcus granulosus thyroid hormone receptor alpha 0.0106 0.4229 0.4229
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0119 0.4847 0.4847
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0225 1 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0225 1 1
Toxoplasma gondii isocitrate dehydrogenase 0.0019 0 0.5
Brugia malayi ecdysone receptor 0.0106 0.4229 0.4229
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.6062 0.6062
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0225 1 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Loa Loa (eye worm) hypothetical protein 0.0225 1 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0225 1 1
Brugia malayi hypothetical protein 0.0119 0.4847 0.4847
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0119 0.4847 0.4847
Echinococcus multilocularis nuclear receptor nhr 48 0.0106 0.4229 0.4229
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0019 0 0.5
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0225 1 1
Loa Loa (eye worm) hypothetical protein 0.0106 0.4229 0.4229
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0225 1 1
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0019 0 0.5
Schistosoma mansoni hypothetical protein 0.0082 0.3064 0.3064
Brugia malayi Nuclear hormone receptor E75 0.0106 0.4229 0.4229
Brugia malayi Steroid receptor seven-up type 2 0.0225 1 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 14.1254 uM PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory) 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) 18.3564 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) 28.1838 uM PubChem BioAssay. qHTS of alpha-syn Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 35.4813 uM PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 39.8107 uM PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 56.2341 uM PubChem BioAssay. qHTS for Antagonist of cAMP-regulated guanine nucleotide exchange factor 2 (EPAC2): primary screen. (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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