Reaction Details | |||
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Target | Free fatty acid receptor 1 | ||
Ligand | BDBM50277728 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_501421 (CHEMBL994680) | ||
IC50 | 10±n/a nM | ||
Citation | Humphries, PS; Benbow, JW; Bonin, PD; Boyer, D; Doran, SD; Frisbie, RK; Piotrowski, DW; Balan, G; Bechle, BM; Conn, EL; Dirico, KJ; Oliver, RM; Soeller, WC; Southers, JA; Yang, X Synthesis and SAR of 1,2,3,4-tetrahydroisoquinolin-1-ones as novel G-protein-coupled receptor 40 (GPR40) antagonists. Bioorg Med Chem Lett19:2400-3 (2009) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Free fatty acid receptor 1 | |||
Name: | Free fatty acid receptor 1 | ||
Synonyms: | FFAR1 | FFAR1_HUMAN | G-protein Coupled Receptor 40 | GPR40 | ||
Type: | G Protein-Coupled Receptor (GPCR) | ||
Mol. Mass.: | 31473.32 | ||
Organism: | Homo sapiens (Human) | ||
Description: | O14842 | ||
Residue: | 300 | ||
Sequence: |
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BDBM50277728 | |||
n/a | |||
Name | BDBM50277728 | ||
Synonyms: | (3R,4R)-3-(4-((cis)-4-methylcyclohexyloxy)phenyl)-1-oxo-2-propyl-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid | CHEMBL484771 | ||
Type | Small organic molecule | ||
Emp. Form. | C26H31NO4 | ||
Mol. Mass. | 421.5286 | ||
SMILES | CCCN1[C@H]([C@H](C(O)=O)c2ccccc2C1=O)c1ccc(O[C@@H]2CC[C@H](C)CC2)cc1 |r,wU:5.5,wD:4.18,22.23,25.27,(-1.08,-.84,;-2.42,-.08,;-2.42,1.46,;-3.76,2.23,;-3.76,3.78,;-5.12,4.56,;-5.12,6.1,;-3.79,6.88,;-6.46,6.86,;-6.45,3.77,;-7.79,4.53,;-9.11,3.76,;-9.12,2.22,;-7.79,1.45,;-6.44,2.21,;-5.1,1.45,;-5.1,-.09,;-2.44,4.55,;-1.1,3.78,;.23,4.56,;.22,6.1,;1.55,6.87,;2.89,6.11,;4.2,6.88,;5.54,6.11,;5.55,4.57,;6.88,3.8,;4.21,3.8,;2.88,4.56,;-1.12,6.86,;-2.45,6.08,)| | ||
Structure |