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BDBM215302 US9296736, 263

SMILES: C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CNS(=O)(=O)c2cccs2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1

InChI Key: InChIKey=NIXWEXNCFVDWBK-JWAZIOJDSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 215302   
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
MDM2 and p53


(Homo sapiens (Human))
BDBM215302
PNG
(US9296736, 263)
Show SMILES C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CNS(=O)(=O)c2cccs2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C29H30Cl2N2O5S2/c1-29(16-25(34)35)15-23(20-4-2-5-22(31)14-20)27(19-9-11-21(30)12-10-19)33(28(29)36)24(18-7-8-18)17-32-40(37,38)26-6-3-13-39-26/h2-6,9-14,18,23-24,27,32H,7-8,15-17H2,1H3,(H,34,35)/t23-,24-,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