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BDBM215362 US9296736, 330::US9593129, Example 330

SMILES: CCCS(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](CC)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1

InChI Key: InChIKey=IPBOIDRBRXAVJG-GCMXZSHTSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 215362   
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))
BDBM215362
PNG
(US9296736, 330 | US9593129, Example 330)
Show SMILES CCCS(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](CC)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1
Show InChI InChI=1S/C29H35Cl2NO5S/c1-3-14-38(36,37)18-25(19-8-9-19)32-27(20-10-12-22(30)13-11-20)24(21-6-5-7-23(31)15-21)16-29(4-2,28(32)35)17-26(33)34/h5-7,10-13,15,19,24-25,27H,3-4,8-9,14,16-18H2,1-2H3,(H,33,34)/t24-,25-,27-,29-/m1/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))
BDBM215362
PNG
(US9296736, 330 | US9593129, Example 330)
Show SMILES CCCS(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](CC)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1
Show InChI InChI=1S/C29H35Cl2NO5S/c1-3-14-38(36,37)18-25(19-8-9-19)32-27(20-10-12-22(30)13-11-20)24(21-6-5-7-23(31)15-21)16-29(4-2,28(32)35)17-26(33)34/h5-7,10-13,15,19,24-25,27H,3-4,8-9,14,16-18H2,1-2H3,(H,33,34)/t24-,25-,27-,29-/m1/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