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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'E3 ubiquitin-protein ligase Mdm2' and Ligand = 'BDBM50053226'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
E3 ubiquitin-protein ligase Mdm2


(Homo sapiens (Human))		BDBM50053226
PNG
(CHEMBL3318784)
Show SMILES CC(C)(C)[C@@H](CS(=O)(=O)N1CCC(F)(F)CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C31H38Cl2F2N2O5S/c1-29(2,3)25(19-43(41,42)36-14-12-31(34,35)13-15-36)37-27(20-8-10-22(32)11-9-20)24(21-6-5-7-23(33)16-21)17-30(4,28(37)40)18-26(38)39/h5-11,16,24-25,27H,12-15,17-19H2,1-4H3,(H,38,39)/t24-,25-,27-,30-/m1/s1
PDB
MMDB

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Article
PubMed
n/an/a 0.370n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Binding affinity to human GST-thrombin-tagged MDM2 assessed as inhibition of interaction with human p53 after 1 hr by HTRF assay in presence of 15% h...

Bioorg Med Chem Lett 24: 3782-5 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.073
BindingDB Entry DOI: 10.7270/Q2ZC84HH
More data for this
Ligand-Target Pair