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BDBM50101748 CHEMBL3394945

SMILES: Cc1cn(cn1)-c1ccc2C(=O)N(Cc3cn(C)c4c(F)cc(cc34)C(F)(F)F)CCn2c1=O

InChI Key: InChIKey=ROILOPRQCLXNJN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50101748   
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
Gamma-Secretase Subunit APH-1A/Gamma-Secretase Subunit PEN-2/Gamma-Secretase Subunit Presenilin-1/Gamma-secretase subunit APH-1B/Nicastrin /Presenilin 2


(Homo sapiens (Human))
BDBM50101748
PNG
(CHEMBL3394945)
Show SMILES Cc1cn(cn1)-c1ccc2C(=O)N(Cc3cn(C)c4c(F)cc(cc34)C(F)(F)F)CCn2c1=O
Show InChI InChI=1S/C23H19F4N5O2/c1-13-9-31(12-28-13)18-3-4-19-21(33)30(5-6-32(19)22(18)34)11-14-10-29(2)20-16(14)7-15(8-17(20)24)23(25,26)27/h3-4,7-10,12H,5-6,11H2,1-2H3
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Similars

Article
PubMed
n/an/a 9n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of gamma-secretase (unknown origin) expressed in CHO cells overexpressing human wild type APP assessed as reduction of amyloid beta 42 lev...


Bioorg Med Chem Lett 25: 908-13 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.059
BindingDB Entry DOI: 10.7270/Q2QV3P8R
More data for this
Ligand-Target Pair