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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Vitamin D3 receptor | ||
| Ligand | BDBM50544015 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1991216 (CHEMBL4624951) | ||
| IC50 | 3198±n/a nM | ||
| Citation |  Masuda, A; Gohda, K; Iguchi, Y; Fujimori, K; Yamashita, Y; Oda, K; Une, M; Teno, N N Bioorg Med Chem28:0 (2020) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Vitamin D3 receptor | |||
| Name: | Vitamin D3 receptor | ||
| Synonyms: | 1,25-dihydroxyvitamin D3 receptor | NR1I1 | Nuclear receptor subfamily 1 group I member 1 | Retinoic acid receptor RXR-alpha/Vitamin D3 receptor | VDR | VDR_HUMAN | ||
| Type: | Protein | ||
| Mol. Mass.: | 48288.72 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P11473 | ||
| Residue: | 427 | ||
| Sequence: |
| ||
| BDBM50544015 | |||
| n/a | |||
| Name | BDBM50544015 | ||
| Synonyms: | CHEMBL4641850 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C30H25Cl2N3O4 | ||
| Mol. Mass. | 562.443 | ||
| SMILES | CC(C)c1onc(c1COc1ccc(cc1)-c1nc2ccc(cc2n1C1CC1)C(O)=O)-c1c(Cl)cccc1Cl |(37.25,-13.03,;37.88,-11.63,;39.41,-11.47,;36.98,-10.38,;35.44,-10.38,;34.96,-8.92,;36.2,-8.01,;37.45,-8.92,;38.92,-8.44,;40.06,-9.47,;41.53,-9,;42.67,-10.03,;44.13,-9.56,;44.46,-8.05,;43.3,-7.01,;41.84,-7.5,;45.92,-7.57,;47.16,-8.47,;48.4,-7.56,;49.9,-7.87,;50.93,-6.73,;50.45,-5.27,;48.95,-4.96,;47.93,-6.1,;46.39,-6.1,;45.48,-4.86,;45.32,-3.32,;44.07,-4.24,;51.47,-4.11,;52.98,-4.43,;50.98,-2.65,;36.19,-6.47,;37.53,-5.69,;38.87,-6.47,;37.53,-4.14,;36.19,-3.38,;34.86,-4.15,;34.86,-5.69,;33.53,-6.47,)| | ||
| Structure | 
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