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Assay Detail

CHEMBL1781077

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

Binding
Displacement of [3H]gabapentin from voltage gated calcium channel alpha2delta from pig cerebral cortex by scintillation counting
28
Total Activities
27
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Sus scrofa
Tissue Cerebral cortex
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Part 2: Design, synthesis and evaluation of hydroxyproline-derived α2δ ligands.
Rawson DJ, Brugier D, Harrison A, Hough J, Newman J, Otterburn J, Maw GN, Price J, Thompson LR, Turnpenny P, Warren AN.
Bioorg Med Chem Lett (2011) 21 : 3767 -3770
PubMed 21550803 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 28 7.12 8.40

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1778785 1 8.40
CHEMBL1778875 1 8.15
CHEMBL1778788 1 7.96
CHEMBL1778874 1 7.85
CHEMBL1778791 1 7.77
CHEMBL1778873 1 7.58
CHEMBL1778789 1 7.52
CHEMBL1778783 1 7.50
CHEMBL1778767 1 7.32
CHEMBL1778792 1 7.28
CHEMBL1778782 1 7.14
CHEMBL1059 PREGABALIN 4.0 1 7.10
CHEMBL1778872 1 7.03
CHEMBL1778786 1 6.99
CHEMBL940 GABAPENTIN 4.0 1 6.85
CHEMBL1778780 1 6.71
CHEMBL1778793 1 6.57
CHEMBL1778877 1 6.49
CHEMBL1778787 1 6.40
CHEMBL1778779 1 6.28
CHEMBL1778876 2 5.90
CHEMBL1778790 1 5.78
CHEMBL1778784 1 -
CHEMBL1778871 1 -
CHEMBL1778781 1 -
CHEMBL1778878 1 -
CHEMBL1778879 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1778785 IC50 = 4.0 nM 8.40
CHEMBL1778875 IC50 = 7.0 nM 8.15
CHEMBL1778788 IC50 = 11.0 nM 7.96
CHEMBL1778874 IC50 = 14.0 nM 7.85
CHEMBL1778791 IC50 = 17.0 nM 7.77
CHEMBL1778873 IC50 = 26.0 nM 7.58
CHEMBL1778789 IC50 = 30.0 nM 7.52
CHEMBL1778783 IC50 = 32.0 nM 7.50
CHEMBL1778767 IC50 = 48.0 nM 7.32
CHEMBL1778792 IC50 = 52.0 nM 7.28
CHEMBL1778782 IC50 = 72.0 nM 7.14
CHEMBL1059 PREGABALIN IC50 = 80.0 nM 7.10
CHEMBL1778872 IC50 = 94.0 nM 7.03
CHEMBL1778786 IC50 = 102.0 nM 6.99
CHEMBL940 GABAPENTIN IC50 = 140.0 nM 6.85
CHEMBL1778780 IC50 = 195.0 nM 6.71
CHEMBL1778793 IC50 = 269.0 nM 6.57
CHEMBL1778877 IC50 = 325.0 nM 6.49
CHEMBL1778787 IC50 = 399.0 nM 6.40
CHEMBL1778779 IC50 = 523.0 nM 6.28
CHEMBL1778876 IC50 = 1260.0 nM 5.90
CHEMBL1778790 IC50 = 1680.0 nM 5.78
CHEMBL1778871 IC50 > 10000.0 nM -
CHEMBL1778784 IC50 > 10000.0 nM -
CHEMBL1778876 IC50 > 10000.0 nM -
CHEMBL1778781 IC50 > 8000.0 nM -
CHEMBL1778878 IC50 > 1000.0 nM -
CHEMBL1778879 IC50 > 1000.0 nM -