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BDBM227699 5-{6-(5-chloropyridin-3- yl)-8-[1-(2- fluorophenyl)ethyl]-7- [(trans-4- methylcyclohexyl)methyl]- 7h-purin-2-yl}-1,3,4- oxadiazol-2(3h)-one (racemate)::US9540377, 23.114

SMILES: CC(c1nc2nc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1n[nH]c(=O)o1)c1ccccc1F

InChI Key: InChIKey=DVKNRKUUMOSOFN-XUWMOKQANA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 227699   
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
p53-binding protein Mdm2


(Homo sapiens (Human))
BDBM227699
PNG
(5-{6-(5-chloropyridin-3- yl)-8-[1-(2- fluorophenyl...)
Show SMILES CC(c1nc2nc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1n[nH]c(=O)o1)c1ccccc1F
Show InChI InChI=1/C28H27ClFN7O2/c1-15-7-9-17(10-8-15)14-37-23-22(18-11-19(29)13-31-12-18)32-25(27-35-36-28(38)39-27)33-24(23)34-26(37)16(2)20-5-3-4-6-21(20)30/h3-6,11-13,15-17H,7-10,14H2,1-2H3,(H,36,38)/t15-,16?,17-
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 2.13n/an/an/an/an/a25



Merck Sharp & Dohme Corp

US Patent


Assay Description
An HDM2 FRET assay was developed to assess the compounds' inhibitory activity towards binding of p53 protein. A truncated version of HDM2 with re...


US Patent US9540377 (2017)


BindingDB Entry DOI: 10.7270/Q2RF5X1F
More data for this
Ligand-Target Pair