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Assay Detail

CHEMBL4400469

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

ADMET
Inhibition of human neutrophil elastase using MeOSuc-AAPV-AMC as substrate incubated for 40 mins by FLINT assay
15
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Neutrophil elastase (CHEMBL248)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design and development of a series of borocycles as selective, covalent kallikrein 5 inhibitors.
Walker AL, Denis A, Bingham RP, Bouillot A, Edgar EV, Ferrie A, Holmes DS, Laroze A, Liddle J, Fouchet MH, Moquette A, Nassau P, Pearce AC, Polyakova O, Smith KJ, Thomas P, Thorpe JH, Trottet L, Wang Y, Hovnanian A.
Bioorg Med Chem Lett (2019) 29 : 126675 -126675
PubMed 31521475 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 5.11 6.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4460168 1 6.10
CHEMBL4461533 1 5.90
CHEMBL4543039 1 5.80
CHEMBL4579813 1 5.30
CHEMBL4535907 1 5.20
CHEMBL4436048 1 4.90
CHEMBL4517343 1 4.80
CHEMBL4536142 1 4.60
CHEMBL4464120 1 4.50
CHEMBL4448315 1 4.00
CHEMBL4447752 1 -
CHEMBL4473069 1 -
CHEMBL4547455 1 -
CHEMBL4558285 1 -
CHEMBL4465265 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4460168 IC50 = 794.33 nM 6.10
CHEMBL4461533 IC50 = 1258.93 nM 5.90
CHEMBL4543039 IC50 = 1584.89 nM 5.80
CHEMBL4579813 IC50 = 5011.87 nM 5.30
CHEMBL4535907 IC50 = 6309.57 nM 5.20
CHEMBL4436048 IC50 = 12589.25 nM 4.90
CHEMBL4517343 IC50 = 15848.93 nM 4.80
CHEMBL4536142 IC50 = 25118.86 nM 4.60
CHEMBL4464120 IC50 = 31622.78 nM 4.50
CHEMBL4448315 IC50 = 100000.0 nM 4.00
CHEMBL4447752 IC50 > 100000.0 nM -
CHEMBL4473069 IC50 > 100000.0 nM -
CHEMBL4547455 IC50 > 100000.0 nM -
CHEMBL4558285 IC50 > 100000.0 nM -
CHEMBL4465265 IC50 > 100000.0 nM -