cholic acid [Ligand Id: 609] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL205596 (Cholic Acid, Cholic acid, NSC-6135, Kolbam, Orphacol, E1000, Cholbam)
  • Farnesoid X receptor/Bile acid receptor FXR in Human [ChEMBL: CHEMBL2047] [GtoPdb: 603] [UniProtKB: Q96RI1]
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  • GPBA receptor/G-protein coupled bile acid receptor 1 in Human [ChEMBL: CHEMBL5409] [GtoPdb: 37] [UniProtKB: Q8TDU6]
  • GPBA receptor/G-protein coupled bile acid receptor 1 in Mouse [ChEMBL: CHEMBL1255150] [GtoPdb: 37] [UniProtKB: Q80SS6]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
Farnesoid X receptor/Bile acid receptor FXR in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2047] [GtoPdb: 603] [UniProtKB: Q96RI1]
ChEMBL Agonist activity at FXR expressed in COS1 cells by cell-based bioluminescence assay F 4 pEC50 >100000 nM EC50 J. Med. Chem. (2009) 52: 7958-7961 [PMID:20014870]
ChEMBL Agonist activity at GST-tagged FXR-LBD using biotinylated-SRC-1 peptide as substrate preincubated with compound for 30 mins measured after 4 hrs F 4 pEC50 >100000 nM EC50 ACS Med. Chem. Lett. (2012) 3: 273-277 [PMID:24900463]
ChEMBL Agonist activity at GST-tagged FXR-LBD (unknown origin) assessed as biotin-labeled SRC-1 recruitment after 30 mins by Alpha Screen assay B 4.35 pEC50 45000 nM EC50 Eur J Med Chem (2018) 144: 349-358 [PMID:29275233]
GPBA receptor/G-protein coupled bile acid receptor 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5409] [GtoPdb: 37] [UniProtKB: Q8TDU6]
ChEMBL Agonist activity at human TGR5 receptor expressed in HEK293 cells assessed as intracellular cAMP level F 5.22 pIC50 6000 nM IC50 Bioorg. Med. Chem. Lett. (2010) 20: 5718-5721 [PMID:20801037]
ChEMBL Agonist activity at wild type TGR5 (unknown origin) B 4.7 pEC50 19830 nM EC50 ACS Med. Chem. Lett. (2013) 4: 1158-1162 [PMID:24900622]
ChEMBL Agonist activity at human TGR5 expressed in CHO cells after 5 hrs by CRE-driven luciferase reporter gene assay F 4.87 pEC50 13600 nM EC50 J. Med. Chem. (2007) 50: 4265-4268 [PMID:17685603]
ChEMBL Agonist activity at human TGR5 expressed in CHO cells by luciferase assay F 4.87 pEC50 13600 nM EC50 J. Med. Chem. (2008) 51: 1831-1841 [PMID:18307294]
ChEMBL Agonist activity at human TGR5 expressed in CHO cells assessed as increase in CRE-driven gene expression by luciferase reporter gene assay F 4.87 pEC50 13600 nM EC50 J. Med. Chem. (2009) 52: 7958-7961 [PMID:20014870]
ChEMBL Agonist activity at TGR5 expressed in NCI-H716 cells assessed as cAMP level after 60 mins by FRET analysis F 4.87 pEC50 13600 nM EC50 ACS Med. Chem. Lett. (2012) 3: 273-277 [PMID:24900463]
GtoPdb - - 5 pEC50 - - - Biochem. Biophys. Res. Commun. (2002) 298: 714-9 [PMID:12419312]
GPBA receptor/G-protein coupled bile acid receptor 1 in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1255150] [GtoPdb: 37] [UniProtKB: Q80SS6]
ChEMBL Agonist activity at mouse TGR5 receptor expressed in HEK293 cells assessed as intracellular cAMP level F 5.28 pIC50 5300 nM IC50 Bioorg. Med. Chem. Lett. (2010) 20: 5718-5721 [PMID:20801037]
Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364]
ChEMBL Antimalarial activity against Plasmodium falciparum NF54 infected in human erythrocytes assessed as reduction in [3H]hypoxanthine incorporation preincubated for 48 hrs followed by [3H]hypoxanthine addition measured after 24 hrs by liquid scintillation counting F 4.7 pIC50 >20000 nM IC50 MedChemComm (2017) 8: 1152-1157

ChEMBL data shown on this page come from version 27:

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]