Reaction Details Report a problem with these data
Target
Induced myeloid leukemia cell differentiation protein Mcl-1
Ligand
BDBM50059667
Substrate
n/a
Meas. Tech.
ChEMBL_1460975 (CHEMBL3396874)
Kd
2500±n/a nM
Citation
 Li, R; Cheng, C; Balasis, ME; Liu, Y; Garner, TP; Daniel, KG; Li, J; Qin, Y; Gavathiotis, E; Sebti, SM Design, synthesis and evaluation of marinopyrrole derivatives as selective inhibitors of Mcl-1 binding to pro-apoptotic Bim and dual Mcl-1/Bcl-xL inhibitors. Eur J Med Chem 90:315-31 (2015) [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:
BDBM50059667
Synonyms:
CHEMBL3393637
Type:
Small organic molecule
Emp. Form.:
C30H16Cl6N8O8
Mol. Mass.:
829.215
SMILES:
OC(=O)Cn1cc(nn1)-c1cc(O)c(cc1Cl)C(=O)c1cc(Cl)c(Cl)n1-c1c(Cl)c(Cl)[nH]c1C(=O)c1cc(Cl)c(cc1O)-c1cn(CC(O)=O)nn1 |(-7.2,3.94,;-6.48,4.94,;-6.99,6.06,;-4.95,4.78,;-4.32,3.38,;-2.81,3.06,;-2.67,1.54,;-4.05,.9,;-5.09,2.04,;-1.33,.77,;,1.54,;1.33,.77,;2.4,1.39,;1.33,-.77,;,-1.54,;-1.33,-.77,;-2.4,-1.39,;2.67,-1.54,;3.73,-.93,;2.66,-3.08,;1.42,-3.96,;1.89,-5.43,;1.16,-6.42,;3.43,-5.43,;4.15,-6.43,;3.91,-3.97,;5.37,-3.49,;5.94,-2.08,;5.29,-1.03,;7.47,-2.2,;8.28,-1.27,;7.83,-3.7,;6.52,-4.5,;6.38,-6.04,;5.27,-6.56,;7.64,-6.92,;9.04,-6.27,;10.3,-7.15,;11.42,-6.63,;10.17,-8.68,;8.77,-9.34,;7.51,-8.45,;6.4,-8.98,;11.43,-9.57,;12.87,-9.05,;13.8,-10.28,;15.34,-10.26,;16.13,-11.58,;15.53,-12.66,;17.36,-11.56,;12.91,-11.54,;11.44,-11.09,)|
Structure:
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