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BDBM215341 US9296736, 309::US9593129, Example 309

SMILES: CC[C@@H](CS(=O)(=O)C1CCOCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1

InChI Key: InChIKey=UGUZZKCDUFSGLL-OCAOGGMISA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 215341   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM215341
PNG
(US9296736, 309 | US9593129, Example 309)
Show SMILES CC[C@@H](CS(=O)(=O)C1CCOCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1
Show InChI InChI=1S/C29H35Cl2NO6S/c1-3-23(18-39(36,37)24-11-13-38-14-12-24)32-27(19-7-9-21(30)10-8-19)25(20-5-4-6-22(31)15-20)16-29(2,28(32)35)17-26(33)34/h4-10,15,23-25,27H,3,11-14,16-18H2,1-2H3,(H,33,34)/t23-,25+,27+,29+/m0/s1
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.200n/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
MDM2 and p53


(Homo sapiens (Human))
BDBM215341
PNG
(US9296736, 309 | US9593129, Example 309)
Show SMILES CC[C@@H](CS(=O)(=O)C1CCOCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1
Show InChI InChI=1S/C29H35Cl2NO6S/c1-3-23(18-39(36,37)24-11-13-38-14-12-24)32-27(19-7-9-21(30)10-8-19)25(20-5-4-6-22(31)15-20)16-29(2,28(32)35)17-26(33)34/h4-10,15,23-25,27H,3,11-14,16-18H2,1-2H3,(H,33,34)/t23-,25+,27+,29+/m0/s1
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.200n/an/an/an/a7.425



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 US9296736 (2016)


BindingDB Entry DOI: 10.7270/Q29022M2
More data for this
Ligand-Target Pair