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Assay Detail

CHEMBL919510

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Binding
Inhibition of BACE1
11
Total Activities
11
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Intermediate

Target

Beta-secretase 1 (CHEMBL4822)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Application of fragment screening by X-ray crystallography to the discovery of aminopyridines as inhibitors of beta-secretase.
Congreve M, Aharony D, Albert J, Callaghan O, Campbell J, Carr RA, Chessari G, Cowan S, Edwards PD, Frederickson M, McMenamin R, Murray CW, Patel S, Wallis N.
J Med Chem (2007) 50 : 1124 -1132
PubMed 17315857 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 11 4.44 6.16

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL220826 1 6.16
CHEMBL220428 1 5.38
CHEMBL220896 1 5.04
CHEMBL220895 1 4.62
CHEMBL221170 1 4.60
CHEMBL220396 1 4.40
CHEMBL221118 1 4.03
CHEMBL220346 1 4.00
CHEMBL435747 1 3.51
CHEMBL61236 1 2.70
CHEMBL219680 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL220826 IC50 = 690.0 nM 6.16
CHEMBL220428 IC50 = 4200.0 nM 5.38
CHEMBL220896 IC50 = 9100.0 nM 5.04
CHEMBL220895 IC50 = 24000.0 nM 4.62
CHEMBL221170 IC50 = 25000.0 nM 4.60
CHEMBL220396 IC50 = 40000.0 nM 4.40
CHEMBL221118 IC50 = 94000.0 nM 4.03
CHEMBL220346 IC50 = 100000.0 nM 4.00
CHEMBL435747 IC50 = 310000.0 nM 3.51
CHEMBL61236 IC50 = 2000000.0 nM 2.70
CHEMBL219680 IC50 > 2000000.0 nM -