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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Adenosylhomocysteinase | ||
| Ligand | BDBM50050882 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1459288 (CHEMBL3367518) | ||
| IC50 | 530±n/a nM | ||
| Citation |  Nakao, A; Suzuki, H; Ueno, H; Iwasaki, H; Setsuta, T Discovery of S-adenosyl-L-homocysteine hydrolase inhibitors based on non-adenosine analogs. Bioorg Med Chem Lett24:4336-40 (2014) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Adenosylhomocysteinase | |||
| Name: | Adenosylhomocysteinase | ||
| Synonyms: | AHCY | Adenosylhomocysteinase | SAHH | SAHH_HUMAN | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 47714.06 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | ChEMBL_1507791 | ||
| Residue: | 432 | ||
| Sequence: |
| ||
| BDBM50050882 | |||
| n/a | |||
| Name | BDBM50050882 | ||
| Synonyms: | CHEMBL3322542 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C35H42Cl2N4O3 | ||
| Mol. Mass. | 637.639 | ||
| SMILES | CN([C@H]1CC[C@@H](CC1)c1ccccc1)C(=O)CN(CC(=O)NCCN1CCCC1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1 |r,wU:2.1,wD:5.8,(23.46,-26.56,;23.46,-25.02,;24.79,-24.24,;24.77,-22.71,;26.11,-21.93,;27.44,-22.7,;27.44,-24.24,;26.12,-25.01,;28.77,-21.94,;30.1,-22.71,;31.43,-21.94,;31.43,-20.4,;30.09,-19.63,;28.76,-20.4,;22.13,-24.26,;20.8,-25.03,;22.12,-22.72,;20.79,-21.95,;20.78,-20.41,;22.11,-19.64,;23.45,-20.4,;22.1,-18.1,;23.44,-17.32,;24.77,-18.09,;26.1,-17.31,;27.5,-17.93,;28.53,-16.78,;27.76,-15.45,;26.25,-15.78,;19.45,-22.73,;19.46,-24.28,;18.12,-25.05,;18.12,-26.59,;16.79,-24.28,;16.79,-22.74,;18.12,-21.96,;18.11,-20.42,;16.78,-19.66,;16.78,-18.12,;15.45,-17.35,;14.11,-18.13,;12.78,-17.36,;14.12,-19.68,;15.46,-20.44,)| | ||
| Structure | 
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