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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 (aa 1-188)' and Ligand = 'BDBM215167'   
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 (aa 1-188)


(Homo sapiens (Human))
BDBM215167
PNG
(US9296736, 118 | US9593129, Example 118)
Show SMILES CC(C)N1[C@@H]([C@H](C[C@@H](CC(O)=O)S1(=O)=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C21H23Cl2NO4S/c1-13(2)24-21(14-6-8-16(22)9-7-14)19(15-4-3-5-17(23)10-15)11-18(12-20(25)26)29(24,27)28/h3-10,13,18-19,21H,11-12H2,1-2H3,(H,25,26)/t18-,19+,21+/m0/s1
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 650n/an/an/an/an/an/a



Amgen, Inc.

US Patent


Assay Description
The standard assay conditions for the in vitro HTRF assay consisted of a 50 ul total reaction volume in black 384-well Costar polypropylene plates in...


US Patent US9593129 (2017)


BindingDB Entry DOI: 10.7270/Q20P1232
More data for this
Ligand-Target Pair