donecopride [Ligand Id: 10584] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL3417009
  • acetylcholinesterase (Cartwright blood group)/Acetylcholinesterase in Human [ChEMBL: CHEMBL220] [GtoPdb: 2465] [UniProtKB: P22303]
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  • 5-HT4 receptor/Serotonin 4 (5-HT4) receptor in Human [ChEMBL: CHEMBL1875] [GtoPdb: 9] [UniProtKB: Q13639]
  • Serotonin 4 (5-HT4) receptor in Guinea pig [ChEMBL: CHEMBL5017] [UniProtKB: O70528]
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  • sigma non-opioid intracellular receptor 1/Sigma opioid receptor in Human [ChEMBL: CHEMBL287] [GtoPdb: 2552] [UniProtKB: Q99720]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
acetylcholinesterase (Cartwright blood group)/Acetylcholinesterase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL220] [GtoPdb: 2465] [UniProtKB: P22303]
ChEMBL Inhibition of AChE (unknown origin) B 7.8 pKi 16 nM Ki Eur J Med Chem (2019) 162: 234-248 [PMID:30447434]
ChEMBL Inhibition of human erythrocyte AChE pre-incubated for 5 mins before acetylthiocholine iodide substrate by Ellman' method B 7.8 pIC50 16 nM IC50 J. Med. Chem. (2015) 58: 3172-3187 [PMID:25793650]
ChEMBL Mixed type competitive inhibition of human AChE using acetylthiocholine iodide as substrate preincubated for 5 mins followed by substrate addition measured every 1 min for 10 mins by Ellman's method B 7.8 pIC50 16 nM IC50 Eur J Med Chem (2018) 158: 463-477 [PMID:30243151]
ChEMBL Inhibition of human erythrocyte AChE using acetylthiocholine iodide as substrate incubated for 5 mins followed by substrate addition by Ellman's method B 7.8 pIC50 16 nM IC50 Eur J Med Chem (2019) 169: 200-223 [PMID:30884327]
GtoPdb - - 7.8 pIC50 16 nM IC50 Proc Natl Acad Sci USA (2014) 111: E3825-30 [PMID:25157130]
Cholinesterase in Equus caballus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5763] [UniProtKB: P81908]
ChEMBL Inhibition of equine serum BuChE pre-incubated for 5 mins before butyrylthiocholine iodide substrate by Ellman' method B 5.45 pIC50 3530 nM IC50 J. Med. Chem. (2015) 58: 3172-3187 [PMID:25793650]
5-HT4 receptor/Serotonin 4 (5-HT4) receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1875] [GtoPdb: 9] [UniProtKB: Q13639]
ChEMBL Agonist activity at 5-HT4R (unknown origin) B 7.98 pKi 10.4 nM Ki Eur J Med Chem (2019) 162: 234-248 [PMID:30447434]
ChEMBL Displacement of [3H]-GR113808 from recombinant human 5-HT4BR expressed in membranes after 60 mins B 8.02 pKi 9.5 nM Ki Eur J Med Chem (2019) 162: 234-248 [PMID:30447434]
ChEMBL Displacement of [3H]GR113808 from human 5-HT4R membrane in Tris buffer assessed as inhibitory constant measured after 60 mins by filter binding method B 8.18 pKi 6.6 nM Ki Eur J Med Chem (2019) 169: 200-223 [PMID:30884327]
ChEMBL Activity at 5-HT4R (unknown origin) expressed in COS7 cells assessed as increase in sAPPalpha release B 7.95 pEC50 11.3 nM EC50 J. Med. Chem. (2015) 58: 3172-3187 [PMID:25793650]
Serotonin 4 (5-HT4) receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5017] [UniProtKB: O70528]
ChEMBL Displacement of [3H]GR113808 from 5-HT4R in guinea pig brain membranes incubated for 30 mins by radioligand binding assay B 8.18 pKi 6.6 nM Ki J. Med. Chem. (2015) 58: 3172-3187 [PMID:25793650]
sigma non-opioid intracellular receptor 1/Sigma opioid receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL287] [GtoPdb: 2552] [UniProtKB: Q99720]
ChEMBL Displacement of [3H]-(+)-pentazocine from sigma-1 receptor in human Jurkat cell membranes after 2 hrs by liquid scintillation counting method B 7.29 pKi 51 nM Ki Eur J Med Chem (2019) 162: 234-248 [PMID:30447434]

ChEMBL data shown on this page come from version 28:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, CibriƔn-Uhalte E, Davies M, Dedman N, Karlsson A, MagariƱos MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]