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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Induced myeloid leukemia cell differentiation protein Mcl-1 | ||
| Ligand | BDBM50519043 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1873795 (CHEMBL4375084) | ||
| Ki | 330±n/a nM | ||
| Citation |  Szlávik, Z; Ondi, L; Csékei, M; Paczal, A; Szabó, ZB; Radics, G; Murray, J; Davidson, J; Chen, I; Davis, B; Hubbard, RE; Pedder, C; Dokurno, P; Surgenor, A; Smith, J; Robertson, A; LeToumelin-Braizat, G; Cauquil, N; Zarka, M; Demarles, D; Perron-Sierra, F; Claperon, A; Colland, F; Geneste, O; Kotschy, A Structure-Guided Discovery of a Selective Mcl-1 Inhibitor with Cellular Activity. J Med Chem62:6913-6924 (2019) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Induced myeloid leukemia cell differentiation protein Mcl-1 | |||
| Name: | Induced myeloid leukemia cell differentiation protein Mcl-1 | ||
| Synonyms: | BCL2L3 | Bcl-2-like protein 3 | Bcl-2-like protein 3 (Mcl-1) | Bcl-2-related protein EAT/mcl1 | Bcl2-L-3 | Induced myeloid leukemia cell differentiation protein (Mcl-1) | MCL1 | MCL1_HUMAN | Mcl-1 | Myeloid Cell factor-1 (Mcl-1) | Myeloid cell leukemia sequence 1 (BCL2-related) | mcl1/EAT | ||
| Type: | Membrane; Single-pass membrane protein | ||
| Mol. Mass.: | 37332.87 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | Q07820 | ||
| Residue: | 350 | ||
| Sequence: |
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| BDBM50519043 | |||
| n/a | |||
| Name | BDBM50519043 | ||
| Synonyms: | CHEMBL4443008 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H21BrN2O3S | ||
| Mol. Mass. | 497.404 | ||
| SMILES | CCc1sc2ncnc(O[C@H](Cc3ccccc3)C(O)=O)c2c1-c1cccc(Br)c1C |r,wU:10.10,(17.07,-14.5,;16.3,-13.16,;14.76,-13.16,;13.86,-14.41,;12.4,-13.94,;11.06,-14.71,;9.72,-13.94,;9.72,-12.4,;11.06,-11.63,;11.06,-10.09,;9.72,-9.32,;9.72,-7.78,;8.38,-7.01,;8.39,-5.47,;7.06,-4.71,;5.72,-5.48,;5.73,-7.03,;7.07,-7.79,;8.39,-10.09,;7.06,-9.33,;8.39,-11.63,;12.4,-12.39,;13.86,-11.92,;14.33,-10.45,;13.3,-9.32,;13.77,-7.86,;15.28,-7.53,;16.31,-8.67,;17.82,-8.34,;15.84,-10.13,;16.88,-11.28,)| | ||
| Structure | 
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