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Assay Detail

CHEMBL5736378

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Binding
In Vitro Direct Determination By Fluorescence: Table 6 & 7: Fresh solutions of each test compound (2.5 mM in DMSO) are diluted in PBS pH=7.4 at concentrations between 0.5 nM and 5 μM in the presence or absence of α-syn (200 nM), Aβ1-42 (500 nM) or Tau (200 nM) fibers in a final 2 mL volume. After 1 h of incubation at RT, the binding of each compound to α-syn, A131-42 or Tau fibers is measured by fluorescence using the spectral changes of the compounds during their binding to the fibers, using the appropriate excitation/emission wavelengths (those giving the highest fluorescence variation during binding to the fibres). For each concentration of compound added to the fibres, the bound and free fractions are measured by fluorescence according to the following equation:F m =F B B+F F×(T−B).
57
Total Activities
11
Compounds Tested
3
Activity Types
0
Assay Parameters

Assay Information

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

Target

Alpha-synuclein (CHEMBL6152)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases
(2021)

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 19 8.69 9.31
kon 19 - -
k_off 19 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5896450 6 9.31
CHEMBL5771524 6 9.28
CHEMBL5790440 3 9.14
CHEMBL5843241 3 9.10
CHEMBL5843281 6 9.00
CHEMBL5759738 3 8.90
CHEMBL6035240 6 8.85
CHEMBL6034599 6 8.62
CHEMBL6001659 6 8.49
CHEMBL207649 6 7.79
CHEMBL1908919 FLORBETAPIR 4.0 6 7.61

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5896450 Kd = 0.49 nM 9.31
CHEMBL5896450 Kd = 0.49 nM 9.31
CHEMBL5771524 Kd = 0.53 nM 9.28
CHEMBL5771524 Kd = 0.53 nM 9.28
CHEMBL5790440 Kd = 0.73 nM 9.14
CHEMBL5843241 Kd = 0.79 nM 9.10
CHEMBL5843281 Kd = 1.0 nM 9.00
CHEMBL5843281 Kd = 1.0 nM 9.00
CHEMBL5759738 Kd = 1.27 nM 8.90
CHEMBL6035240 Kd = 1.4 nM 8.85
CHEMBL6035240 Kd = 1.4 nM 8.85
CHEMBL6034599 Kd = 2.4 nM 8.62
CHEMBL6034599 Kd = 2.4 nM 8.62
CHEMBL6001659 Kd = 3.25 nM 8.49
CHEMBL6001659 Kd = 3.25 nM 8.49
CHEMBL207649 Kd = 16.1 nM 7.79
CHEMBL207649 Kd = 16.1 nM 7.79
CHEMBL1908919 FLORBETAPIR Kd = 24.3 nM 7.61
CHEMBL1908919 FLORBETAPIR Kd = 24.3 nM 7.61
CHEMBL5843241 k_off = - s-1 -
CHEMBL5843241 kon = - -
CHEMBL5843281 k_off = - s-1 -
CHEMBL1908919 FLORBETAPIR kon = - -
CHEMBL6001659 k_off = - s-1 -
CHEMBL6001659 kon = - -
CHEMBL6035240 k_off = - s-1 -
CHEMBL6035240 kon = - -
CHEMBL5771524 k_off = - s-1 -
CHEMBL5771524 kon = - -
CHEMBL207649 k_off = - s-1 -
CHEMBL207649 kon = - -
CHEMBL1908919 FLORBETAPIR k_off = - s-1 -
CHEMBL1908919 FLORBETAPIR kon = - -
CHEMBL5843281 kon = - -
CHEMBL6034599 k_off = - s-1 -
CHEMBL6034599 kon = - -
CHEMBL5896450 k_off = - s-1 -
CHEMBL5896450 kon = - -
CHEMBL5843281 k_off = - s-1 -
CHEMBL5843281 kon = - -
CHEMBL6001659 k_off = - s-1 -
CHEMBL6001659 kon = - -
CHEMBL6035240 k_off = - s-1 -
CHEMBL6035240 kon = - -
CHEMBL5771524 k_off = - s-1 -
CHEMBL5759738 kon = - -
CHEMBL5771524 kon = - -
CHEMBL207649 kon = - -
CHEMBL207649 k_off = - s-1 -
CHEMBL1908919 FLORBETAPIR k_off = - s-1 -