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Assay Detail

CHEMBL823916

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

Binding
Binding affinity against alpha-3-beta-3-gamma-2 GABAA/BzR receptor subtype.
56
Total Activities
56
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-3/beta-3/gamma-2 (CHEMBL2094120)
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 56 7.29 9.28

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL130609 1 9.28
CHEMBL407 FLUMAZENIL 4.0 1 8.98
CHEMBL6597 Ro-154513 1 8.60
CHEMBL57655 1 8.38
CHEMBL6421 1 8.25
CHEMBL341398 1 8.17
CHEMBL133272 1 8.16
CHEMBL133049 1 8.13
CHEMBL6655 1 8.04
CHEMBL415290 Ro-151310 1 8.04
CHEMBL336728 1 8.00
CHEMBL6659 1 7.96
CHEMBL133219 1 7.89
CHEMBL336377 1 7.82
CHEMBL59180 1 7.78
CHEMBL416450 1 7.77
CHEMBL58757 1 7.73
CHEMBL132529 1 7.72
CHEMBL58570 1 7.60
CHEMBL286594 1 7.59
CHEMBL58385 1 7.58
CHEMBL339163 1 7.57
CHEMBL52030 1 7.56
CHEMBL415293 1 7.54
CHEMBL7290 1 7.52
CHEMBL339165 1 7.42
CHEMBL6440 1 7.37
CHEMBL130416 1 7.32
CHEMBL6814 1 7.30
CHEMBL129855 1 7.10

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL130609 Ki = 0.53 nM 9.28
CHEMBL407 FLUMAZENIL Ki = 1.05 nM 8.98
CHEMBL6597 Ro-154513 Ki = 2.5 nM 8.60
CHEMBL57655 Ki = 4.14 nM 8.38
CHEMBL6421 Ki = 5.66 nM 8.25
CHEMBL341398 Ki = 6.7 nM 8.17
CHEMBL133272 Ki = 6.9 nM 8.16
CHEMBL133049 Ki = 7.42 nM 8.13
CHEMBL6655 Ki = 9.2 nM 8.04
CHEMBL415290 Ro-151310 Ki = 9.2 nM 8.04
CHEMBL336728 Ki = 10.0 nM 8.00
CHEMBL6659 Ki = 10.9 nM 7.96
CHEMBL133219 Ki = 13.0 nM 7.89
CHEMBL336377 Ki = 15.0 nM 7.82
CHEMBL59180 Ki = 16.5 nM 7.78
CHEMBL416450 Ki = 16.9 nM 7.77
CHEMBL58757 Ki = 18.7 nM 7.73
CHEMBL132529 Ki = 19.0 nM 7.72
CHEMBL58570 Ki = 25.3 nM 7.60
CHEMBL286594 Ki = 25.8 nM 7.59
CHEMBL58385 Ki = 26.1 nM 7.58
CHEMBL339163 Ki = 27.0 nM 7.57
CHEMBL52030 Ki = 27.5 nM 7.56
CHEMBL415293 Ki = 29.1 nM 7.54
CHEMBL7290 Ki = 30.2 nM 7.52
CHEMBL339165 Ki = 38.1 nM 7.42
CHEMBL6440 Ki = 42.5 nM 7.37
CHEMBL130416 Ki = 48.0 nM 7.32
CHEMBL6814 Ki = 50.0 nM 7.30
CHEMBL129855 Ki = 79.0 nM 7.10
CHEMBL134175 Ki = 85.0 nM 7.07
CHEMBL336636 Ki = 91.0 nM 7.04
CHEMBL337166 Ki = 91.0 nM 7.04
CHEMBL335888 Ki = 97.0 nM 7.01
CHEMBL133112 Ki = 102.0 nM 6.99
CHEMBL133705 Ki = 122.0 nM 6.91
CHEMBL340546 Ki = 148.0 nM 6.83
CHEMBL131977 Ki = 169.0 nM 6.77
CHEMBL339172 Ki = 184.0 nM 6.74
CHEMBL59181 Ki = 198.4 nM 6.70
CHEMBL300840 Ki = 255.0 nM 6.59
CHEMBL335960 Ki = 337.0 nM 6.47
CHEMBL43718 Ki = 1125.0 nM 5.95
CHEMBL43724 Ki = 2739.0 nM 5.56
CHEMBL45174 Ki = 2907.0 nM 5.54
CHEMBL46957 Ki = 6266.0 nM 5.20
CHEMBL47853 Ki = 15409.0 nM 4.81
CHEMBL43725 Ki = 22125.0 nM 4.66
CHEMBL44784 Ki > 300.0 nM -
CHEMBL445856 Ki > 1000.0 nM -