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Assay Detail

CHEMBL824296

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

Binding
Binding affinity tested against alpha-2-beta-3-gamma-2 GABAA/BzR receptor subtype.
49
Total Activities
49
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 7 — Homologous single protein target
Curated By Autocuration

Target

GABA-A receptor; alpha-2/beta-3/gamma-2 (CHEMBL2094130)
Type PROTEIN COMPLEX
Organism Homo sapiens

Publication

Predictive models for GABAA/benzodiazepine receptor subtypes: studies of quantitative structure-activity relationships for imidazobenzodiazepines at five recombinant GABAA/benzodiazepine receptor subtypes [alphaxbeta3gamma2 (x = 1-3, 5, and 6)] via comparative molecular field analysis.
Huang Q, Liu R, Zhang P, He X, McKernan R, Gan T, Bennett DW, Cook JM.
J Med Chem (1998) 41 : 4130 -4142
PubMed 9767648 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 49 7.13 9.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL407 FLUMAZENIL 4.0 1 9.05
CHEMBL6597 Ro-154513 1 8.59
CHEMBL57655 1 8.14
CHEMBL133272 1 7.99
CHEMBL6655 1 7.97
CHEMBL6659 1 7.95
CHEMBL336728 1 7.92
CHEMBL341398 1 7.89
CHEMBL415290 Ro-151310 1 7.79
CHEMBL415293 1 7.67
CHEMBL286594 1 7.67
CHEMBL59180 1 7.65
CHEMBL58757 1 7.58
CHEMBL58385 1 7.57
CHEMBL52030 1 7.56
CHEMBL336377 1 7.54
CHEMBL6814 1 7.47
CHEMBL416450 1 7.44
CHEMBL134175 1 7.40
CHEMBL339163 1 7.36
CHEMBL132529 1 7.35
CHEMBL6440 1 7.32
CHEMBL7290 1 7.30
CHEMBL58570 1 7.25
CHEMBL337166 1 7.25
CHEMBL130416 1 7.22
CHEMBL336636 1 7.16
CHEMBL335888 1 7.07
CHEMBL133705 1 7.06
CHEMBL129855 1 6.91

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL407 FLUMAZENIL Ki = 0.9 nM 9.05
CHEMBL6597 Ro-154513 Ki = 2.6 nM 8.59
CHEMBL57655 Ki = 7.2 nM 8.14
CHEMBL133272 Ki = 10.2 nM 7.99
CHEMBL6655 Ki = 10.7 nM 7.97
CHEMBL6659 Ki = 11.2 nM 7.95
CHEMBL336728 Ki = 12.0 nM 7.92
CHEMBL341398 Ki = 13.0 nM 7.89
CHEMBL415290 Ro-151310 Ki = 16.3 nM 7.79
CHEMBL415293 Ki = 21.6 nM 7.67
CHEMBL286594 Ki = 21.4 nM 7.67
CHEMBL59180 Ki = 22.2 nM 7.65
CHEMBL58757 Ki = 26.3 nM 7.58
CHEMBL58385 Ki = 27.0 nM 7.57
CHEMBL52030 Ki = 27.4 nM 7.56
CHEMBL336377 Ki = 29.0 nM 7.54
CHEMBL6814 Ki = 33.7 nM 7.47
CHEMBL416450 Ki = 36.0 nM 7.44
CHEMBL134175 Ki = 40.0 nM 7.40
CHEMBL339163 Ki = 44.0 nM 7.36
CHEMBL132529 Ki = 45.0 nM 7.35
CHEMBL6440 Ki = 48.2 nM 7.32
CHEMBL7290 Ki = 49.8 nM 7.30
CHEMBL337166 Ki = 56.0 nM 7.25
CHEMBL58570 Ki = 56.0 nM 7.25
CHEMBL130416 Ki = 60.0 nM 7.22
CHEMBL336636 Ki = 70.0 nM 7.16
CHEMBL335888 Ki = 85.0 nM 7.07
CHEMBL133705 Ki = 88.0 nM 7.06
CHEMBL129855 Ki = 124.0 nM 6.91
CHEMBL59181 Ki = 141.9 nM 6.85
CHEMBL300840 Ki = 143.0 nM 6.84
CHEMBL339172 Ki = 150.0 nM 6.82
CHEMBL133112 Ki = 318.0 nM 6.50
CHEMBL335960 Ki = 387.0 nM 6.41
CHEMBL43718 Ki = 1527.0 nM 5.82
CHEMBL45174 Ki = 2900.0 nM 5.54
CHEMBL43724 Ki = 2865.0 nM 5.54
CHEMBL46957 Ki = 12590.0 nM 4.90
CHEMBL47853 Ki = 30000.0 nM 4.52
CHEMBL43725 Ki = 33834.0 nM 4.47
CHEMBL336133 Ki > 1000.0 nM -
CHEMBL432104 Ki > 300.0 nM -
CHEMBL45346 Ki > 300.0 nM -
CHEMBL44784 Ki > 300.0 nM -
CHEMBL445856 Ki > 1000.0 nM -
CHEMBL295277 Ki > 300.0 nM -
CHEMBL134241 Ki > 1000.0 nM -
CHEMBL295981 Ki > 300.0 nM -