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Assay Detail

CHEMBL5241710

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of BACE1 (unknown origin)
52
Total Activities
52
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

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

Publication

Dual-target compounds for Alzheimer's disease: Natural and synthetic AChE and BACE-1 dual-inhibitors and their structure-activity relationship (SAR).
Ferreira JPS, Albuquerque HMT, Cardoso SM, Silva AMS, Silva VLM.
Eur J Med Chem (2021) 221 : 113492 -113492
PubMed 33984802 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 52 6.76 9.68

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5197518 1 9.68
CHEMBL5269238 1 9.32
CHEMBL5286535 1 9.21
CHEMBL5266033 1 9.20
CHEMBL5272625 1 9.06
CHEMBL5289994 1 8.77
CHEMBL5267312 1 8.68
CHEMBL5277927 1 8.53
CHEMBL226335 RUTIN 3.0 1 8.42
CHEMBL5273978 1 8.35
CHEMBL5291052 1 8.33
CHEMBL5279409 1 8.23
CHEMBL444478 ACETOSIDE 2.0 1 8.20
CHEMBL5265752 1 7.86
CHEMBL5272243 1 7.80
CHEMBL5274465 1 7.78
CHEMBL1613299 1 7.74
CHEMBL5266286 1 7.73
CHEMBL5268019 1 7.72
CHEMBL5278429 1 7.65
CHEMBL5275941 1 7.60
CHEMBL5282833 1 7.49
CHEMBL1950045 HYDROXYTYROSOL 3.0 1 7.46
CHEMBL5272974 1 7.15
CHEMBL5287982 1 6.61
CHEMBL5268811 1 6.60
CHEMBL5274016 1 6.56
CHEMBL151 LUTEOLIN 2.0 1 6.28
CHEMBL50 QUERCETIN 3.0 1 6.26
CHEMBL5287353 1 6.14

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5197518 IC50 = 0.211 nM 9.68
CHEMBL5269238 IC50 = 0.479 nM 9.32
CHEMBL5286535 IC50 = 0.624 nM 9.21
CHEMBL5266033 IC50 = 0.628 nM 9.20
CHEMBL5272625 IC50 = 0.864 nM 9.06
CHEMBL5289994 IC50 = 1.69 nM 8.77
CHEMBL5267312 IC50 = 2.07 nM 8.68
CHEMBL5277927 IC50 = 2.96 nM 8.53
CHEMBL226335 RUTIN IC50 = 3.8 nM 8.42
CHEMBL5273978 IC50 = 4.45 nM 8.35
CHEMBL5291052 IC50 = 4.703 nM 8.33
CHEMBL5279409 IC50 = 5.87 nM 8.23
CHEMBL444478 ACETOSIDE IC50 = 6.3 nM 8.20
CHEMBL5265752 IC50 = 13.82 nM 7.86
CHEMBL5272243 IC50 = 15.74 nM 7.80
CHEMBL5274465 IC50 = 16.69 nM 7.78
CHEMBL1613299 IC50 = 18.3 nM 7.74
CHEMBL5266286 IC50 = 18.5 nM 7.73
CHEMBL5268019 IC50 = 19.1 nM 7.72
CHEMBL5278429 IC50 = 22.44 nM 7.65
CHEMBL5275941 IC50 = 25.07 nM 7.60
CHEMBL5282833 IC50 = 32.18 nM 7.49
CHEMBL1950045 HYDROXYTYROSOL IC50 = 35.0 nM 7.46
CHEMBL5272974 IC50 = 70.79 nM 7.15
CHEMBL5287982 IC50 = 243.0 nM 6.61
CHEMBL5268811 IC50 = 253.0 nM 6.60
CHEMBL5274016 IC50 = 277.0 nM 6.56
CHEMBL151 LUTEOLIN IC50 = 520.0 nM 6.28
CHEMBL50 QUERCETIN IC50 = 550.0 nM 6.26
CHEMBL5287353 IC50 = 730.0 nM 6.14
CHEMBL5277231 IC50 = 1040.0 nM 5.98
CHEMBL443626 IC50 = 1620.0 nM 5.79
CHEMBL5278221 IC50 = 2030.0 nM 5.69
CHEMBL5274481 IC50 = 2340.0 nM 5.63
CHEMBL5272371 IC50 = 2760.0 nM 5.56
CHEMBL2235239 Moslosooflavone IC50 = 2910.0 nM 5.54
CHEMBL249448 IC50 = 3310.0 nM 5.48
CHEMBL517247 MULBERROFURAN D IC50 = 3740.0 nM 5.43
CHEMBL28 APIGENIN IC50 = 3790.0 nM 5.42
CHEMBL5280671 IC50 = 5640.0 nM 5.25
CHEMBL471187 ECKOL IC50 = 7670.0 nM 5.12
CHEMBL5278532 IC50 = 9740.0 nM 5.01
CHEMBL4097388 IC50 = 10700.0 nM 4.97
CHEMBL5270046 IC50 = 13600.0 nM 4.87
CHEMBL5273380 IC50 = 15800.0 nM 4.80
CHEMBL145 CAFFEIC ACID IC50 = 16670.0 nM 4.78
CHEMBL5288752 IC50 = 17300.0 nM 4.76
CHEMBL4089910 IC50 = 18000.0 nM 4.75
CHEMBL5288184 IC50 = 25300.0 nM 4.60
CHEMBL5287890 IC50 = 28900.0 nM 4.54