Reaction Details | |||
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Target | Motilin receptor | ||
Ligand | BDBM50599725 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_2231450 (CHEMBL5145222) | ||
EC50 | 2.1±n/a nM | ||
Citation | Toda, N; Shida, T; Takano, R; Katagiri, T; Hirouchi, M; Abe, M; Soma, K; Nakagami, Y; Yamazaki, M Discovery of DS-3801b, a non-macrolide GPR38 agonist with N-methylanilide structure. Bioorg Med Chem Lett59:0 (2022) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Motilin receptor | |||
Name: | Motilin receptor | ||
Synonyms: | G-protein coupled receptor 38 | GPR38 | MLNR | MTLR | MTLR1 | MTLR_HUMAN | ||
Type: | PROTEIN | ||
Mol. Mass.: | 45365.95 | ||
Organism: | Homo sapiens (Human) | ||
Description: | ChEMBL_122664 | ||
Residue: | 412 | ||
Sequence: |
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BDBM50599725 | |||
n/a | |||
Name | BDBM50599725 | ||
Synonyms: | CHEMBL5187928 | ||
Type | Small organic molecule | ||
Emp. Form. | C27H36FN3O2 | ||
Mol. Mass. | 453.592 | ||
SMILES | C[C@H]1CN(Cc2ccc(cc2C)N(C)C(=O)[C@H]2CC[C@@H](CC2)Oc2ccc(F)cc2)CCN1 |r,wU:1.0,16.16,wD:19.23,(-2.66,3.47,;-4,2.7,;-4,1.16,;-5.33,.39,;-5.33,-1.15,;-4,-1.92,;-2.66,-1.15,;-1.33,-1.92,;-1.33,-3.46,;-2.66,-4.23,;-4,-3.47,;-5.33,-4.24,;-0,-4.23,;-0,-5.77,;1.33,-3.46,;2.67,-4.23,;1.33,-1.92,;-0,-1.15,;-0,.39,;1.33,1.16,;2.67,.39,;2.67,-1.15,;1.33,2.7,;2.67,3.47,;2.67,5.01,;4,5.77,;5.33,5,;6.66,5.77,;5.33,3.47,;4.01,2.69,;-6.66,1.16,;-6.66,2.7,;-5.33,3.47,)| | ||
Structure |