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Target
Induced myeloid leukemia cell differentiation protein Mcl-1
Ligand
BDBM597052
Substrate
n/a
Meas. Tech.
TR-FRET Binding Assay
Ki
<0.200±n/a nM
Citation
 Lee, T; Tarr, JC; Jeon, K; Salovich, JM; Shaw, S; Veerasamy, N; Kim, K; Christov, PP; Olejniczak, ET; Zhao, B; Fesik, SW; Bian, Z Substituted indole Mcl-1 inhibitors US Patent  US11596639 Publication Date 3/7/2023 
Target
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:
MFGLKRNAVIGLNLYCGGAGLGAGSGGATRPGGRLLATEKEASARREIGGGEAGAVIGGSAGASPPSTLTPDSRRVARPPPIGAEVPDVTATPARLLFFAPTRRAAPLEEMEAPAADAIMSPEEELDGYEPEPLGKRPAVLPLLELVGESGNNTSTDGSLPSTPPPAEEEEDELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGVQRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISFGAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFHVEDLEGGIRNVLLAFAGVAGVGAGLAYLIR
  
Inhibitor
Name:
BDBM597052
Synonyms:
US11596639, Example 651
Type:
Small organic molecule
Emp. Form.:
C38H36Cl2N6O4
Mol. Mass.:
711.636
SMILES:
C[C@@H]1CN(c2cn(C)c3ccc(nc23)C(O)=O)C(=O)c2c(CCCOc3cc(C)c(Cl)c(C)c3)c3ccc(Cl)c(-c4c(C)ncnc4C)c3n12 |r,wD:1.0,(-.81,5.36,;-.81,3.82,;.72,3.98,;1.62,2.73,;3.16,2.89,;4.22,1.77,;5.61,2.44,;6.94,1.67,;5.41,3.96,;6.41,5.13,;5.89,6.59,;4.38,6.87,;3.38,5.7,;3.89,4.24,;3.86,8.32,;2.35,8.6,;4.87,9.49,;1,1.32,;1.89,.07,;-.53,1.16,;-1.44,-.08,;-.97,-1.55,;.54,-1.88,;1.03,-3.34,;2.53,-3.67,;3.02,-5.13,;4.53,-5.4,;5.06,-6.84,;6.57,-7.16,;4.07,-8.02,;4.54,-9.49,;2.55,-7.76,;1.58,-8.95,;2.03,-6.31,;-2.9,.39,;-4.24,-.38,;-5.57,.39,;-5.57,1.93,;-6.94,2.64,;-4.24,2.7,;-4.24,4.24,;-5.57,5.01,;-6.9,4.24,;-5.57,6.55,;-4.24,7.32,;-2.9,6.55,;-2.9,5.01,;-1.57,4.24,;-2.9,1.93,;-1.44,2.41,)|
Structure:
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