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Assay Detail

CHEMBL4393356

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

ADMET
Inhibition of human MMP9 using (7-methoxycoumarin-4-yl)acetyl-Pro-Leu-Gly-Leu-(3-(2,4-dinitrophenyl)-L-2,3-diamino-propionyl)Ala-Arg-NH2 as substrate preincubated for 30 mins followed by substrate addition and measured by fluorescence assay
14
Total Activities
14
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

Matrix metalloproteinase-9 (CHEMBL321)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Proline-based hydroxamates targeting the zinc-dependent deacetylase LpxC: Synthesis, antibacterial properties, and docking studies.
Kalinin DV, Agoglitta O, Van de Vyver H, Melesina J, Wagner S, Riemann B, Schäfers M, Sippl W, Löffler B, Holl R.
Bioorg Med Chem (2019) 27 : 1997 -2018
PubMed 30954331 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 6.25 7.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL267178 1 7.96
CHEMBL4584968 1 6.97
CHEMBL4527411 1 6.92
CHEMBL4452902 1 6.14
CHEMBL4437091 1 6.07
CHEMBL4441587 1 6.00
CHEMBL4536692 1 5.75
CHEMBL4592738 1 5.40
CHEMBL4556395 1 5.05
CHEMBL4463640 1 -
CHEMBL4449693 1 -
CHEMBL4539203 1 -
CHEMBL4465363 1 -
CHEMBL4465665 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL267178 IC50 = 11.0 nM 7.96
CHEMBL4584968 IC50 = 108.0 nM 6.97
CHEMBL4527411 IC50 = 120.0 nM 6.92
CHEMBL4452902 IC50 = 731.0 nM 6.14
CHEMBL4437091 IC50 = 845.0 nM 6.07
CHEMBL4441587 IC50 = 1000.0 nM 6.00
CHEMBL4536692 IC50 = 1800.0 nM 5.75
CHEMBL4592738 IC50 = 4000.0 nM 5.40
CHEMBL4556395 IC50 = 9000.0 nM 5.05
CHEMBL4463640 IC50 > 10000.0 nM -
CHEMBL4449693 IC50 > 10000.0 nM -
CHEMBL4539203 IC50 > 10000.0 nM -
CHEMBL4465363 IC50 > 10000.0 nM -
CHEMBL4465665 IC50 > 10000.0 nM -