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Target
Menin
Ligand
BDBM50455857
Substrate
n/a
Meas. Tech.
ChEMBL_1755017 (CHEMBL4189777)
IC50
55±n/a nM
Citation
 Borkin, D; Klossowski, S; Pollock, J; Miao, H; Linhares, BM; Kempinska, K; Jin, Z; Purohit, T; Wen, B; He, M; Sun, D; Cierpicki, T; Grembecka, J Complexity of Blocking Bivalent Protein-Protein Interactions: Development of a Highly Potent Inhibitor of the Menin-Mixed-Lineage Leukemia Interaction. J Med Chem 61:4832-4850 (2018) [PubMed]  Article
Target
Name:
Menin
Synonyms:
MEN1 | MEN1_HUMAN | Menin/Histone-lysine N-methyltransferase MLL | SCG2
Type:
Protein
Mol. Mass.:
68022.55
Organism:
Homo sapiens (Human)
Description:
O00255
Residue:
610
Sequence:
MGLKAAQKTLFPLRSIDDVVRLFAAELGREEPDLVLLSLVLGFVEHFLAVNRVIPTNVPELTFQPSPAPDPPGGLTYFPVADLSIIAALYARFTAQIRGAVDLSLYPREGGVSSRELVKKVSDVIWNSLSRSYFKDRAHIQSLFSFITGTKLDSSGVAFAVVGACQALGLRDVHLALSEDHAWVVFGPNGEQTAEVTWHGKGNEDRRGQTVNAGVAERSWLYLKGSYMRCDRKMEVAFMVCAINPSIDLHTDSLELLQLQQKLLWLLYDLGHLERYPMALGNLADLEELEPTPGRPDPLTLYHKGIASAKTYYRDEHIYPYMYLAGYHCRNRNVREALQAWADTATVIQDYNYCREDEEIYKEFFEVANDVIPNLLKEAASLLEAGEERPGEQSQGTQSQGSALQDPECFAHLLRFYDGICKWEEGSPTPVLHVGWATFLVQSLGRFEGQVRQKVRIVSREAEAAEAEEPWGEEAREGRRRGPRRESKPEEPPPPKKPALDKGLGTGQGAVSGPPRKPPGTVAGTARGPEGGSTAQVPAPTASPPPEGPVLTFQSEKMKGMKELLVATKINSSAIKLQLTAQSQVQMKKQKVSTPSDYTLSFLKRQRKGL
  
Inhibitor
Name:
BDBM50455857
Synonyms:
CHEMBL4218711
Type:
Small organic molecule
Emp. Form.:
C32H39F3N8O2S2
Mol. Mass.:
688.83
SMILES:
CCS(=O)(=O)N1CCN(CCn2c(cc3c(C)c(CN4CCC(CC4)Nc4ncnc5sc(CC(F)(F)F)cc45)ccc23)C#N)CC1
Structure:
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