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BDBM119409 US8669252, 9

SMILES: FC(F)(F)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(Cl)cc1

InChI Key: InChIKey=FXJNQJYEWRFHCH-SSWODZADSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 119409   
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
Prolylcarboxypeptidase (PRCP)


(Homo sapiens (Human))
BDBM119409
PNG
(US8669252, 9)
Show SMILES FC(F)(F)C(NC(=O)[C@@H]1CC[C@H](C[C@H]1c1ccc(Br)cc1)N1CCOCC1)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C25H27BrClF3N2O2/c26-18-5-1-16(2-6-18)22-15-20(32-11-13-34-14-12-32)9-10-21(22)24(33)31-23(25(28,29)30)17-3-7-19(27)8-4-17/h1-8,20-23H,9-15H2,(H,31,33)/t20-,21-,22+,23?/m1/s1
PDB
MMDB

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Similars

US Patent
n/an/a 2.10n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The potency of compounds of formula I against PrCP was determined by a fluorescence intensity kinetic assay measuring the IC50 values of PrCP inhibit...


US Patent US8669252 (2014)


BindingDB Entry DOI: 10.7270/Q2J9652X
More data for this
Ligand-Target Pair