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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Retinoic acid receptor RXR-beta | ||
| Ligand | BDBM50340649 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1734798 (CHEMBL4150334) | ||
| EC50 | 27100±n/a nM | ||
| Citation |  Merk, D; Grisoni, F; Friedrich, L; Gelzinyte, E; Schneider, G Computer-Assisted Discovery of Retinoid X Receptor Modulating Natural Products and Isofunctional Mimetics. J Med Chem61:5442-5447 (2018) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Retinoic acid receptor RXR-beta | |||
| Name: | Retinoic acid receptor RXR-beta | ||
| Synonyms: | NR2B2 | Nuclear receptor subfamily 2 group B member 2 | RXRB | RXRB_HUMAN | Retinoic acid receptor RXR-beta | Retinoid X receptor beta | Retinoid receptor | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 56932.89 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | ChEMBL_39045 | ||
| Residue: | 533 | ||
| Sequence: |
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| BDBM50340649 | |||
| n/a | |||
| Name | BDBM50340649 | ||
| Synonyms: | CHEMBL4163199 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C18H25F2NO2 | ||
| Mol. Mass. | 325.3934 | ||
| SMILES | Cc1c(C)n(C[C@H]2CC[C@@H](CC2)C(O)=O)c2CCC(F)(F)Cc12 |r,wU:9.12,wD:6.5,(54.45,-4.82,;54.93,-6.28,;54.03,-7.53,;52.49,-7.54,;54.94,-8.78,;54.48,-10.25,;55.52,-11.38,;55.05,-12.85,;56.09,-13.98,;57.59,-13.65,;58.06,-12.18,;57.02,-11.04,;58.63,-14.79,;60.13,-14.46,;58.16,-16.25,;56.41,-8.3,;57.75,-9.06,;59.08,-8.3,;59.08,-6.75,;59.84,-5.41,;60.62,-6.74,;57.75,-5.97,;56.4,-6.75,)| | ||
| Structure | 
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