Reaction Details Report a problem with these data
Target
E3 ubiquitin-protein ligase Mdm2
Ligand
BDBM535378
Substrate
n/a
Meas. Tech.
Binding Assay (ELISA)
IC50
27.0±n/a nM
Citation
 Chessari, G; Lyons, JF Combination of isoindolinone derivatives with SGI-110 US Patent  US11236047 Publication Date 2/1/2022 
Target
Name:
E3 ubiquitin-protein ligase Mdm2
Synonyms:
MDM2_HUMAN | MDM2 | Double minute 2 protein | Double minute 2 protein (HDM2) | E3 ubiquitin-protein ligase Mdm2 (p53-binding protein Mdm2) | Hdm2 | Human Double Minute 2 (HDM2) | p53-Binding Protein MDM2 | p53-binding protein | MDM2-MDMX
Type:
Oncoprotein
Mol. Mass.:
55196.54
Organism:
Human
Description:
Q00987
Residue:
491
Sequence:
MCNTNMSVPTDGAVTTSQIPASEQETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQYIMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEHRKIYTMIYRNLVVVNQQESSDSGTSVSENRCHLEGGSDQKDLVQELQEEKPSSSHLVSRPSTSSRRRAISETEENSDELSGERQRKRHKSDSISLSFDESLALCVIREICCERSSSSESTGTPSNPDLDAGVSEHSGDWLDQDSVSDQFSVEFEVESLDSEDYSLSEEGQELSDEDDEVYQVTVYQAGESDTDSFEEDPEISLADYWKCTSCNEMNPPLPSHCNRCWALRENWLPEDKGKDKGEISEKAKLENSTQAEEGFDVPDCKKTIVNDSRESCVEENDDKITQASQSQESEDYSQPSTSSSIIYSSQEDVKEFEREETQDKEESVESSLPLNAIEPCVICQGRPKNGCIVHGKTGHLMACFTCAKKLKKRNKPCPVCRQPIQMIVLTYFP
  
Inhibitor
Name:
BDBM535378
Synonyms:
(3R)-3-(4-chlorophenyl)-2-[(5- chloropyridin-2-yl)methyl]-4-fluoro-6- [1-hydroxy-1-(1-methyl-1H-pyrazol-4- yl)ethyl]-3-[cis-3-hydroxycyclobutoxy]- 2,3-dihydro-1H-isoindol-1-one | US11236047, Example 208 | US11236047, Example 205 | US20230338337, Compound 208
Type:
Small organic molecule
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:23.25,25.26,27.29,(-7.24,1.34,;-6.61,-.07,;-5.1,-.39,;-4.94,-1.92,;-6.35,-2.55,;-7.38,-1.4,;-3.61,-2.69,;-4.38,-4.03,;-2.84,-4.03,;-2.28,-1.92,;-.94,-2.69,;.39,-1.92,;1.86,-2.4,;2.33,-3.86,;2.76,-1.15,;4.3,-1.15,;5.07,-2.49,;4.3,-3.82,;5.07,-5.15,;6.61,-5.15,;7.38,-6.49,;7.38,-3.82,;6.61,-2.49,;1.86,.09,;1.05,1.41,;1.45,2.9,;2.78,3.67,;2.01,5,;2.41,6.49,;.68,4.23,;.39,-.38,;-.94,.39,;-.94,1.93,;-2.28,-.38,;2.94,1.18,;4.43,.78,;5.52,1.87,;5.12,3.36,;6.21,4.45,;3.63,3.76,;2.55,2.67,)|
Structure:
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