Reaction Details | |||
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Target | Prostaglandin D2 receptor 2 | ||
Ligand | BDBM50401103 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_884446 (CHEMBL2212208) | ||
IC50 | >1000±n/a nM | ||
Citation | Kaila, N; Huang, A; Moretto, A; Follows, B; Janz, K; Lowe, M; Thomason, J; Mansour, TS; Hubeau, C; Page, K; Morgan, P; Fish, S; Xu, X; Williams, C; Saiah, E Diazine indole acetic acids as potent, selective, and orally bioavailable antagonists of chemoattractant receptor homologous molecule expressed on Th2 cells (CRTH2) for the treatment of allergic inflammatory diseases. J Med Chem55:5088-109 (2012) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Prostaglandin D2 receptor 2 | |||
Name: | Prostaglandin D2 receptor 2 | ||
Synonyms: | CD_antigen=CD294 | CRTH2 | Chemoattractant Receptor-homologous molecule expressed on T-helper type 2 cells (CRTH2) | Chemoattractant receptor-homologous molecule expressed on Th2 cells | Chemoattractant receptor-homologous molecule expressed on Th2 cells (CRTH2) | DL1R | G protein-coupled receptor 44 | G-protein coupled receptor 44 | GPR44 | PD2R2_HUMAN | PTGDR2 | Prostaglandin D2 | Prostaglandin D2 receptor 2 | Prostaglandin D2 receptor 2 (PGD2) | ||
Type: | Enzyme | ||
Mol. Mass.: | 43295.45 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Q9Y5Y4 | ||
Residue: | 395 | ||
Sequence: |
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BDBM50401103 | |||
n/a | |||
Name | BDBM50401103 | ||
Synonyms: | CHEMBL2205153 | ||
Type | Small organic molecule | ||
Emp. Form. | C30H28N4O2 | ||
Mol. Mass. | 476.5689 | ||
SMILES | Cc1c(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)c2ccccc2n1CC(=O)N1CCCC1 |(37.67,-22.1,;36.13,-22.1,;35.22,-20.85,;35.99,-19.52,;37.53,-19.53,;38.31,-18.21,;39.85,-18.21,;40.61,-19.55,;39.83,-20.87,;40.59,-22.2,;42.13,-22.21,;42.91,-20.87,;42.14,-19.54,;37.54,-16.87,;38.32,-15.54,;36,-16.86,;35.23,-15.53,;33.68,-15.53,;32.91,-16.88,;33.69,-18.21,;35.23,-18.2,;33.75,-21.33,;32.41,-20.57,;31.09,-21.34,;31.08,-22.88,;32.42,-23.65,;33.75,-22.88,;35.22,-23.36,;35.7,-24.82,;34.67,-25.96,;35.14,-27.43,;33.16,-25.65,;32.53,-24.25,;31,-24.42,;30.69,-25.92,;32.02,-26.69,)| | ||
Structure |