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BDBM50101793 CHEMBL3394941

SMILES: Cc1cn(cn1)-c1ccc2C(=O)N(Cc3cnn4ccc(cc34)C(F)(F)F)CCn2c1=O

InChI Key: InChIKey=VMSOTCHPXVSCJY-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50101793   
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))
BDBM50101793
PNG
(CHEMBL3394941)
Show SMILES Cc1cn(cn1)-c1ccc2C(=O)N(Cc3cnn4ccc(cc34)C(F)(F)F)CCn2c1=O
Show InChI InChI=1S/C21H17F3N6O2/c1-13-10-28(12-25-13)16-2-3-17-19(31)27(6-7-29(17)20(16)32)11-14-9-26-30-5-4-15(8-18(14)30)21(22,23)24/h2-5,8-10,12H,6-7,11H2,1H3
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
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GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 605n/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