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BDBM152962 US8993614, 23

SMILES: COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)NCC(=O)OCc1ccccc1

InChI Key: InChIKey=SERBIEOQNLXPMC-IVAXWGMXNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 152962   
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


(Homo sapiens (Human))
BDBM152962
PNG
(US8993614, 23)
Show SMILES COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)NCC(=O)OCc1ccccc1
Show InChI InChI=1/C43H42Cl2F2N4O8/c1-24(59-41(55)49-21-35(52)57-22-25-10-7-6-8-11-25)58-40(54)26-14-17-32(33(18-26)56-5)50-39(53)38-36(28-12-9-13-30(45)37(28)47)43(23-48,34(51-38)20-42(2,3)4)29-16-15-27(44)19-31(29)46/h6-19,24,34,36,38,51H,20-22H2,1-5H3,(H,49,55)(H,50,53)/t24?,34-,36-,38+,43-/s2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 11n/an/an/an/an/an/a



F. Hoffmann-La Roche Inc

US Patent


Assay Description
The ability of the compounds to inhibit the interaction between p53 and MDM2 proteins was measured by an HTRF (homogeneous time-resolved fluorescence...


US Patent US8993614 (2015)


BindingDB Entry DOI: 10.7270/Q27W69XV
More data for this
Ligand-Target Pair