Reaction Details | |||
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Target | Induced myeloid leukemia cell differentiation protein Mcl-1 | ||
Ligand | BDBM429057 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1884336 (CHEMBL4385918) | ||
Ki | 6.7±n/a nM | ||
Citation | Lee, T; Christov, PP; Shaw, S; Tarr, JC; Zhao, B; Veerasamy, N; Jeon, KO; Mills, JJ; Bian, Z; Sensintaffar, JL; Arnold, AL; Fogarty, SA; Perry, E; Ramsey, HE; Cook, RS; Hollingshead, M; Davis Millin, M; Lee, KM; Koss, B; Budhraja, A; Opferman, JT; Kim, K; Arteaga, CL; Moore, WJ; Olejniczak, ET; Savona, MR; Fesik, SW Discovery of Potent Myeloid Cell Leukemia-1 (Mcl-1) Inhibitors That Demonstrate in Vivo Activity in Mouse Xenograft Models of Human Cancer. J Med Chem62:3971-3988 (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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BDBM429057 | |||
n/a | |||
Name | BDBM429057 | ||
Synonyms: | US10533010, Example I-154 | US11208415, Example I-154 | ||
Type | Small organic molecule | ||
Emp. Form. | C37H38Cl2N4O4 | ||
Mol. Mass. | 673.628 | ||
SMILES | C[C@@H]1CN(Cc2ccc(cc2)C(O)=O)C(=O)c2c(CCCOc3cc(C)c(Cl)c(C)c3)c3ccc(Cl)c(-c4c(C)nn(C)c4C)c3n12 |r,wD:1.0,(-.86,5.12,;-.46,3.63,;1.07,3.8,;1.98,2.55,;3.47,2.95,;3.87,4.44,;5.35,4.83,;5.75,6.32,;4.68,7.46,;3.18,7.01,;2.78,5.52,;5.08,8.95,;3.99,10.04,;6.56,9.35,;1.35,1.14,;2.12,-.19,;-.18,.98,;-1.08,-.26,;-.68,-1.75,;.8,-2.15,;1.2,-3.64,;2.69,-4.04,;3.09,-5.52,;4.57,-5.92,;4.97,-7.41,;6.46,-7.81,;3.88,-8.5,;4.28,-9.99,;2.4,-8.1,;1.31,-9.19,;2,-6.61,;-2.55,.21,;-3.88,-.56,;-5.22,.21,;-5.22,1.75,;-6.55,2.52,;-3.88,2.52,;-3.88,4.06,;-2.64,4.97,;-1.3,4.2,;-3.11,6.43,;-4.65,6.43,;-5.42,7.76,;-5.13,4.97,;-6.46,4.2,;-2.55,1.75,;-1.08,2.23,)| | ||
Structure |