Ki Summary

Reaction Details

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Target

E3 ubiquitin-protein ligase Mdm2

Ligand

BDBM162141

Substrate/Competitor

n/a

Meas. Tech.

Time Resolved Fluorescence Energy Transfer (TR-FRET) Assay

IC50

5.7±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

More Info.:

Get all data from this article, Assay Method

E3 ubiquitin-protein ligase Mdm2

Name:

E3 ubiquitin-protein ligase Mdm2

Synonyms:

Type:

Oncoprotein

Mol. Mass.:

55196.54

Organism:

Homo sapiens (Human)

Description:

Q00987

Residue:

491

Sequence:

MCNTNMSVPTDGAVTTSQIPASEQETLVRPKPLLLKLLKSVGAQKDTYTMKEVLFYLGQY
IMTKRLYDEKQQHIVYCSNDLLGDLFGVPSFSVKEHRKIYTMIYRNLVVVNQQESSDSGT
SVSENRCHLEGGSDQKDLVQELQEEKPSSSHLVSRPSTSSRRRAISETEENSDELSGERQ
RKRHKSDSISLSFDESLALCVIREICCERSSSSESTGTPSNPDLDAGVSEHSGDWLDQDS
VSDQFSVEFEVESLDSEDYSLSEEGQELSDEDDEVYQVTVYQAGESDTDSFEEDPEISLA
DYWKCTSCNEMNPPLPSHCNRCWALRENWLPEDKGKDKGEISEKAKLENSTQAEEGFDVP
DCKKTIVNDSRESCVEENDDKITQASQSQESEDYSQPSTSSSIIYSSQEDVKEFEREETQ
DKEESVESSLPLNAIEPCVICQGRPKNGCIVHGKTGHLMACFTCAKKLKKRNKPCPVCRQ
PIQMIVLTYFP

BDBM162141

n/a

Name

BDBM162141

Synonyms:

US9051279, 124

Type

Small organic molecule

Emp. Form.

C36H44ClN5O4

Mol. Mass.

646.219

SMILES

COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cn1)N(C)C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)C1 |r,wU:36.43,wD:9.9,33.36,(6.1,3.54,;6.1,2,;4.77,1.23,;3.44,2,;2.1,1.23,;.77,2,;-.56,1.23,;-1.9,2,;-.56,-.31,;.77,-1.08,;.77,-2.62,;-.56,-3.39,;-.56,-4.93,;.77,-5.7,;.77,-7.24,;2.1,-4.93,;2.1,-3.39,;2.1,-.31,;3.44,-1.08,;4.77,-.31,;6.1,-1.08,;7.44,-.31,;8.77,-1.08,;7.44,1.23,;-1.9,-1.08,;-1.9,-2.62,;-3.23,-3.39,;-4.56,-2.62,;-4.56,-1.08,;-3.23,-.31,;-5.9,-3.39,;-5.9,-4.93,;-7.23,-2.62,;-7.23,-1.08,;-5.9,-.31,;-5.9,1.23,;-7.23,2,;-8.57,1.23,;-8.57,-.31,;-7.23,3.54,;-8.48,4.44,;-8,5.91,;-8.77,7.24,;-6.46,5.91,;-5.69,7.24,;-5.99,4.44,)|

Structure