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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Induced myeloid leukemia cell differentiation protein Mcl-1 | ||
| Ligand | BDBM50519052 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1873795 (CHEMBL4375084) | ||
| Ki | 51±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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| BDBM50519052 | |||
| n/a | |||
| Name | BDBM50519052 | ||
| Synonyms: | CHEMBL4515048 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H21ClN2O4S | ||
| Mol. Mass. | 468.953 | ||
| SMILES | CCc1sc2ncnc(O[C@H](Cc3ccccc3)C(O)=O)c2c1-c1ccc(O)c(Cl)c1C |r,wU:10.10,(19.06,-48.95,;18.29,-47.62,;16.75,-47.62,;15.85,-48.87,;14.39,-48.39,;13.05,-49.17,;11.71,-48.4,;11.71,-46.85,;13.05,-46.08,;13.05,-44.54,;11.71,-43.78,;11.71,-42.24,;10.38,-41.47,;10.38,-39.93,;9.05,-39.16,;7.71,-39.93,;7.72,-41.48,;9.06,-42.24,;10.38,-44.55,;9.05,-43.78,;10.38,-46.09,;14.39,-46.85,;15.85,-46.37,;16.32,-44.91,;15.29,-43.77,;15.76,-42.31,;17.27,-41.98,;17.74,-40.52,;18.3,-43.12,;19.81,-42.8,;17.84,-44.59,;18.87,-45.73,)| | ||
| Structure | 
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