Reaction Details  Report a problem with these data
Target
Induced myeloid leukemia cell differentiation protein Mcl-1
Ligand
BDBM50201737
Substrate
n/a
Meas. Tech.
ChEMBL_1623372 (CHEMBL3865724)
Ki
85±n/a nM
Citation
 Lu, Y; Wu, S; Yue, Y; He, S; Li, J; Tang, J; Wang, W; Zhou, HB Gossypol with Hydrophobic Linear Esters Exhibits Enhanced Antitumor Activity as an Inhibitor of Antiapoptotic Proteins. ACS Med Chem Lett 7:1185-1190 (2016) [PubMed]  Article
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:
BDBM50201737
Synonyms:
CHEMBL1962393
Type:
Small organic molecule
Emp. Form.:
C40H48N2O10
Mol. Mass.:
716.8165
SMILES:
CC(C)C1=C(O)C(=O)\C(=C/NCCCCC(O)=O)c2c(O)c(c(C)cc12)-c1c(C)cc2C(C(C)C)=C(O)C(=O)\C(=C/NCCCCC(O)=O)c2c1O |c:3,t:36,(2.5,-24.54,;3.83,-23.77,;5.17,-24.53,;3.83,-22.23,;2.49,-21.46,;1.16,-22.22,;2.49,-19.91,;1.16,-19.14,;3.82,-19.14,;3.82,-17.6,;2.48,-16.83,;1.15,-17.61,;-.19,-16.84,;-1.52,-17.62,;-2.85,-16.85,;-4.18,-17.62,;-5.52,-16.86,;-4.18,-19.16,;5.16,-19.9,;6.48,-19.13,;6.53,-17.89,;7.82,-19.89,;7.83,-21.44,;9.17,-22.21,;6.49,-22.21,;5.16,-21.45,;9.14,-19.12,;9.13,-17.58,;7.79,-16.82,;10.45,-16.8,;11.8,-17.56,;13.12,-16.79,;13.11,-15.25,;14.43,-14.47,;11.76,-14.49,;14.45,-17.54,;15.78,-16.76,;14.47,-19.08,;15.81,-19.84,;13.14,-19.86,;13.15,-21.4,;14.49,-22.16,;15.82,-21.38,;17.16,-22.14,;18.48,-21.37,;19.82,-22.13,;21.15,-21.35,;22.49,-22.11,;21.14,-19.81,;11.81,-19.1,;10.48,-19.88,;10.49,-21.42,)|
Structure:
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