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Assay Detail

CHEMBL674886

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Binding
Binding affinity against human leukocyte elastase (HLE) enzyme
42
Total Activities
42
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Neutrophil elastase (CHEMBL248)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Nonpeptidic inhibitors of human leukocyte elastase. 3. Design, synthesis, X-ray crystallographic analysis, and structure-activity relationships for a series of orally active 3-amino-6-phenylpyridin-2-one trifluoromethyl ketones.
Bernstein PR, Andisik D, Bradley PK, Bryant CB, Ceccarelli C, Damewood JR, Earley R, Edwards PD, Feeney S, Gomes BC.
J Med Chem (1994) 37 : 3313 -3326
PubMed 7932559 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 42 7.81 9.15

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL307315 1 9.15
CHEMBL431864 1 8.85
CHEMBL282694 1 8.74
CHEMBL354883 1 8.60
CHEMBL55210 1 8.51
CHEMBL113187 1 8.39
CHEMBL11391 1 8.35
CHEMBL333835 1 8.32
CHEMBL280916 1 8.24
CHEMBL304354 1 8.22
CHEMBL113110 1 8.16
CHEMBL113358 1 8.15
CHEMBL275043 1 8.10
CHEMBL303165 1 8.08
CHEMBL113905 1 8.06
CHEMBL325870 1 8.06
CHEMBL111955 1 8.03
CHEMBL114868 1 8.03
CHEMBL113725 1 7.89
CHEMBL109306 1 7.89
CHEMBL324983 1 7.82
CHEMBL113014 1 7.82
CHEMBL326238 1 7.82
CHEMBL113148 1 7.82
CHEMBL278222 1 7.80
CHEMBL279250 1 7.75
CHEMBL324343 1 7.75
CHEMBL424620 1 7.64
CHEMBL66520 1 7.58
CHEMBL325713 1 7.52

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL307315 Ki = 0.7 nM 9.15
CHEMBL431864 Ki = 1.4 nM 8.85
CHEMBL282694 Ki = 1.8 nM 8.74
CHEMBL354883 Ki = 2.5 nM 8.60
CHEMBL55210 Ki = 3.1 nM 8.51
CHEMBL113187 Ki = 4.1 nM 8.39
CHEMBL11391 Ki = 4.5 nM 8.35
CHEMBL333835 Ki = 4.8 nM 8.32
CHEMBL280916 Ki = 5.7 nM 8.24
CHEMBL304354 Ki = 6.0 nM 8.22
CHEMBL113110 Ki = 6.9 nM 8.16
CHEMBL113358 Ki = 7.0 nM 8.15
CHEMBL275043 Ki = 8.0 nM 8.10
CHEMBL303165 Ki = 8.4 nM 8.08
CHEMBL325870 Ki = 8.7 nM 8.06
CHEMBL113905 Ki = 8.8 nM 8.06
CHEMBL111955 Ki = 9.3 nM 8.03
CHEMBL114868 Ki = 9.4 nM 8.03
CHEMBL113725 Ki = 13.0 nM 7.89
CHEMBL109306 Ki = 13.0 nM 7.89
CHEMBL113148 Ki = 15.0 nM 7.82
CHEMBL113014 Ki = 15.0 nM 7.82
CHEMBL324983 Ki = 15.0 nM 7.82
CHEMBL326238 Ki = 15.0 nM 7.82
CHEMBL278222 Ki = 16.0 nM 7.80
CHEMBL279250 Ki = 18.0 nM 7.75
CHEMBL324343 Ki = 18.0 nM 7.75
CHEMBL424620 Ki = 23.0 nM 7.64
CHEMBL66520 Ki = 26.0 nM 7.58
CHEMBL325713 Ki = 30.0 nM 7.52
CHEMBL113129 Ki = 34.0 nM 7.47
CHEMBL113409 Ki = 39.0 nM 7.41
CHEMBL112410 Ki = 43.0 nM 7.37
CHEMBL325503 Ki = 52.0 nM 7.28
CHEMBL112924 Ki = 52.0 nM 7.28
CHEMBL418841 Ki = 57.0 nM 7.24
CHEMBL13923 Ki = 62.0 nM 7.21
CHEMBL109396 Ki = 71.0 nM 7.15
CHEMBL112335 Ki = 80.0 nM 7.10
CHEMBL323443 Ki = 190.0 nM 6.72
CHEMBL14516 Ki = 469.0 nM 6.33
CHEMBL68841 Ki = 480.0 nM 6.32