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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Bile acid receptor | ||
| Ligand | BDBM50355022 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_772465 (CHEMBL1839256) | ||
| EC50 | 140±n/a nM | ||
| Citation |  Akwabi-Ameyaw, A; Caravella, JA; Chen, L; Creech, KL; Deaton, DN; Madauss, KP; Marr, HB; Miller, AB; Navas, F; Parks, DJ; Spearing, PK; Todd, D; Williams, SP; Wisely, GB Conformationally constrained farnesoid X receptor (FXR) agonists: alternative replacements of the stilbene. Bioorg Med Chem Lett21:6154-60 (2011) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Bile acid receptor | |||
| Name: | Bile acid receptor | ||
| Synonyms: | BAR | Bile acid receptor FXR | FXR | Farnesol receptor HRR-1 | HRR1 | NR1H4 | NR1H4_HUMAN | Nuclear receptor subfamily 1 group H member 4 | RIP14 | RXR-interacting protein 14 | Retinoid X receptor-interacting protein 14 | farnesoid x receptor | ||
| Type: | Nuclear Receptor | ||
| Mol. Mass.: | 55916.24 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q96RI1 | ||
| Residue: | 486 | ||
| Sequence: |
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| BDBM50355022 | |||
| n/a | |||
| Name | BDBM50355022 | ||
| Synonyms: | CHEMBL1833985 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C28H22Cl2N2O4 | ||
| Mol. Mass. | 521.391 | ||
| SMILES | CC(C)c1onc(c1COc1ccc(cc1)-c1ccc2cc([nH]c2c1)C(O)=O)-c1c(Cl)cccc1Cl |(4.85,-36.74,;4.54,-38.24,;3.07,-38.73,;5.69,-39.27,;7.19,-38.94,;7.97,-40.27,;6.94,-41.42,;5.53,-40.8,;4.2,-41.58,;2.86,-40.81,;1.53,-41.59,;1.54,-43.14,;.2,-43.91,;-1.13,-43.14,;-1.13,-41.6,;.2,-40.82,;-2.46,-43.91,;-2.5,-45.44,;-3.86,-46.17,;-5.17,-45.38,;-6.64,-45.82,;-7.52,-44.56,;-6.59,-43.33,;-5.13,-43.84,;-3.78,-43.1,;-9.06,-44.52,;-9.8,-43.17,;-9.87,-45.83,;7.27,-42.93,;8.73,-43.39,;9.86,-42.35,;9.06,-44.89,;7.92,-45.93,;6.45,-45.46,;6.12,-43.96,;4.66,-43.48,)| | ||
| Structure | 
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