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Target
E3 ubiquitin-protein ligase Mdm2
Ligand
BDBM161955
Substrate
n/a
Meas. Tech.
Time Resolved Fluorescence Energy Transfer (TR-FRET) Assay
IC50
202.6±n/a nM
Citation
 Berghausen, J; Buschmann, N; Furet, P; Gessier, F; Hergovich Lisztwan, J; Holzer, P; Jacoby, E; Kallen, J; Masuya, K; Pissot Soldermann, C; Ren, H; Stutz, S Substituted isoquinolinones and quinazolinones US Patent  US9051279 Publication Date 6/9/2015 
Target
Name:
E3 ubiquitin-protein ligase Mdm2
Synonyms:
Double minute 2 protein | Double minute 2 protein (HDM2) | E3 ubiquitin-protein ligase Mdm2 (p53-binding protein Mdm2) | Hdm2 | Human Double Minute 2 (HDM2) | MDM2 | MDM2-MDMX | MDM2_HUMAN | p53-Binding Protein MDM2 | p53-binding protein
Type:
Oncoprotein
Mol. Mass.:
55196.54
Organism:
Homo sapiens (Human)
Description:
Q00987
Residue:
491
Sequence:
MCNTNMSVPTDGAVTTSQIPASEQETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEHRKIYTMIYRNLVVVNQQESSDSGTSVSENRCHLEGGSDQKDLVQELQEEKPSSSHLVSRPSTSSRRRAISETEENSDELSGERQRKRHKSDSISLSFDESLALCVIREICCERSSSSESTGTPSNPDLDAGVSEHSGDWLDQDSVSDQFSVEFEVESLDSEDYSLSEEGQELSDEDDEVYQVTVYQAGESDTDSFEEDPEISLADYWKCTSCNEMNPPLPSHCNRCWALRENWLPEDKGKDKGEISEKAKLENSTQAEEGFDVPDCKKTIVNDSRESCVEENDDKITQASQSQESEDYSQPSTSSSIIYSSQEDVKEFEREETQDKEESVESSLPLNAIEPCVICQGRPKNGCIVHGKTGHLMACFTCAKKLKKRNKPCPVCRQPIQMIVLTYFP
  
Inhibitor
Name:
BDBM161955
Synonyms:
US9051279, 64
Type:
Small organic molecule
Emp. Form.:
C37H48ClN3O3
Mol. Mass.:
618.248
SMILES:
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N(C)[C@@H]1CC[C@@H](CC1)N(C)C)c1ccc(Cl)cc1 |r,wD:31.37,28.30,2.2,(9.34,1.15,;8,.38,;6.67,1.15,;6.67,2.69,;5.33,.38,;4,1.15,;2.67,.38,;1.33,1.15,;,.38,;-1.33,1.15,;-1.33,2.69,;-2.67,3.47,;,3.47,;1.33,2.69,;2.67,3.47,;4,2.69,;5.33,3.47,;5.33,5,;-2.67,.38,;-2.67,-1.15,;-4,-1.93,;-5.33,-1.15,;-5.33,.38,;-4,1.15,;-6.67,-1.93,;-6.67,-3.47,;-8,-1.15,;-9.34,-1.93,;-8,.38,;-9.34,1.15,;-9.34,2.69,;-8,3.47,;-6.67,2.69,;-6.67,1.15,;-8,5,;-9.34,5.78,;-6.67,5.78,;,-1.15,;-1.33,-1.93,;-1.33,-3.47,;,-4.23,;,-5.78,;1.33,-3.47,;1.33,-1.93,)|
Structure:
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