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Target
E3 ubiquitin-protein ligase Mdm2
Ligand
BDBM50041074
Substrate
n/a
Meas. Tech.
ChEMBL_1445462 (CHEMBL3380268)
IC50
17±n/a nM
Citation
 Aguilar, A; Sun, W; Liu, L; Lu, J; McEachern, D; Bernard, D; Deschamps, JR; Wang, S Design of chemically stable, potent, and efficacious MDM2 inhibitors that exploit the retro-mannich ring-opening-cyclization reaction mechanism in spiro-oxindoles. J Med Chem 57:10486-98 (2014) [PubMed]  Article 
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:
BDBM50041074
Synonyms:
CHEMBL3355416
Type:
Small organic molecule
Emp. Form.:
C29H32Cl2FN3O3
Mol. Mass.:
560.487
SMILES:
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:18.31,19.22,4.7,wD:10.10,1.0,(9.07,-38.56,;8.68,-40.05,;7.19,-40.45,;6.79,-41.95,;7.89,-43.02,;9.37,-42.62,;9.77,-41.14,;7.5,-44.51,;6.01,-44.92,;4.92,-43.83,;5.62,-46.41,;7.12,-46.73,;7.28,-48.26,;8.04,-49.59,;9.56,-49.59,;10.34,-48.27,;9.57,-46.94,;8.04,-46.93,;5.88,-48.89,;4.85,-47.75,;3.75,-46.65,;4.15,-45.15,;3.06,-44.05,;1.55,-44.45,;1.15,-45.96,;-.34,-46.37,;2.26,-47.06,;1.86,-48.54,;6.79,-50.15,;8.33,-50.14,;5.89,-51.41,;4.41,-50.94,;3.07,-51.71,;1.74,-50.94,;.4,-51.71,;1.74,-49.39,;3.07,-48.62,;4.4,-49.39,)|
Structure:
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