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Assay Detail

CHEMBL650075

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

Binding
Inhibition on Benzodiazepine receptor
43
Total Activities
43
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 4 — Cell-line / Tissue
Curated By Autocuration

Target

GABA-A receptor; anion channel (CHEMBL2093872)
Type PROTEIN COMPLEX GROUP
Organism Homo sapiens

Publication

Three-dimensional quantitative structure-activity relationships from molecular similarity matrices and genetic neural networks. 2. Applications.
So SS, Karplus M.
J Med Chem (1997) 40 : 4360 -4371
PubMed 9435905 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 43 6.75 10.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3144739 1 10.00
CHEMBL19732 CGS-8216 1 9.40
CHEMBL20042 CGS-9896 1 9.22
CHEMBL301605 1 8.40
CHEMBL453066 BETA-CCM 1 8.30
CHEMBL11709 1 8.30
CHEMBL66273 1 8.10
CHEMBL307783 1 8.00
CHEMBL52750 1 7.96
CHEMBL69719 1 7.64
CHEMBL299250 1 7.62
CHEMBL298561 1 7.35
CHEMBL66274 1 7.17
CHEMBL1269093 1 7.03
CHEMBL128348 1 7.02
CHEMBL66902 1 7.01
CHEMBL54228 1 6.91
CHEMBL53229 1 6.90
CHEMBL69336 1 6.80
CHEMBL304273 1 6.65
CHEMBL69488 1 6.64
CHEMBL67774 1 6.60
CHEMBL129742 1 6.45
CHEMBL87641 1 6.37
CHEMBL86231 1 6.33
CHEMBL67421 1 6.29
CHEMBL66487 1 6.17
CHEMBL302056 1 6.15
CHEMBL67951 1 6.12
CHEMBL87331 1 6.00

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3144739 IC50 = 0.1 nM 10.00
CHEMBL19732 CGS-8216 IC50 = 0.3981 nM 9.40
CHEMBL20042 CGS-9896 IC50 = 0.6026 nM 9.22
CHEMBL301605 IC50 = 3.981 nM 8.40
CHEMBL453066 BETA-CCM IC50 = 5.012 nM 8.30
CHEMBL11709 IC50 = 5.012 nM 8.30
CHEMBL66273 IC50 = 7.943 nM 8.10
CHEMBL307783 IC50 = 10.0 nM 8.00
CHEMBL52750 IC50 = 10.96 nM 7.96
CHEMBL69719 IC50 = 22.91 nM 7.64
CHEMBL299250 IC50 = 23.99 nM 7.62
CHEMBL298561 IC50 = 44.67 nM 7.35
CHEMBL66274 IC50 = 67.61 nM 7.17
CHEMBL1269093 IC50 = 93.33 nM 7.03
CHEMBL128348 IC50 = 95.5 nM 7.02
CHEMBL66902 IC50 = 97.72 nM 7.01
CHEMBL54228 IC50 = 123.03 nM 6.91
CHEMBL53229 IC50 = 125.89 nM 6.90
CHEMBL69336 IC50 = 158.49 nM 6.80
CHEMBL304273 IC50 = 223.87 nM 6.65
CHEMBL69488 IC50 = 229.09 nM 6.64
CHEMBL67774 IC50 = 251.19 nM 6.60
CHEMBL129742 IC50 = 354.81 nM 6.45
CHEMBL87641 IC50 = 426.58 nM 6.37
CHEMBL86231 IC50 = 467.74 nM 6.33
CHEMBL67421 IC50 = 512.86 nM 6.29
CHEMBL66487 IC50 = 676.08 nM 6.17
CHEMBL302056 IC50 = 707.95 nM 6.15
CHEMBL67951 IC50 = 758.58 nM 6.12
CHEMBL87331 IC50 = 1000.0 nM 6.00
CHEMBL299060 IC50 = 1174.9 nM 5.93
CHEMBL275224 NORHARMANE IC50 = 1621.81 nM 5.79
CHEMBL55630 IC50 = 1698.24 nM 5.77
CHEMBL53230 IC50 = 1949.84 nM 5.71
CHEMBL69282 IC50 = 1949.84 nM 5.71
CHEMBL66841 IC50 = 2398.83 nM 5.62
CHEMBL303932 IC50 = 5754.4 nM 5.24
CHEMBL69006 IC50 = 6918.31 nM 5.16
CHEMBL12063 IC50 = 7585.78 nM 5.12
CHEMBL70086 IC50 = 8511.38 nM 5.07
CHEMBL12014 HARMAN IC50 = 12302.69 nM 4.91
CHEMBL67772 IC50 = 25703.96 nM 4.59
CHEMBL441986 IC50 = 251188.64 nM -