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Assay Detail

CHEMBL839592

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

Binding
Inhibition of Matrix metalloprotease-13 (MMP-13)
37
Total Activities
37
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Collagenase 3 (CHEMBL280)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis and structure-activity relationship of a novel sulfone series of TNF-alpha converting enzyme inhibitors.
Xue CB, Chen XT, He X, Roderick J, Corbett RL, Ghavimi B, Liu RQ, Covington MB, Qian M, Ribadeneira MD, Vaddi K, Trzaskos J, Newton RC, Duan JJ, Decicco CP.
Bioorg Med Chem Lett (2004) 14 : 4453 -4459
PubMed 15357971 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 37 5.94 6.42

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL363968 1 6.42
CHEMBL185159 1 6.30
CHEMBL359569 1 6.22
CHEMBL184553 1 6.18
CHEMBL185321 1 6.12
CHEMBL184062 1 6.12
CHEMBL364875 1 6.12
CHEMBL184302 1 6.09
CHEMBL185279 1 6.02
CHEMBL365905 1 5.92
CHEMBL184885 1 5.77
CHEMBL363732 1 5.75
CHEMBL185587 1 5.58
CHEMBL182730 1 5.49
CHEMBL184782 1 5.49
CHEMBL365031 1 5.41
CHEMBL363261 1 -
CHEMBL361376 1 -
CHEMBL184975 1 -
CHEMBL184200 1 -
CHEMBL184266 1 -
CHEMBL183828 1 -
CHEMBL185160 1 -
CHEMBL434348 1 -
CHEMBL183868 1 -
CHEMBL184889 1 -
CHEMBL364589 1 -
CHEMBL185397 1 -
CHEMBL185521 1 -
CHEMBL359625 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL363968 Ki = 377.0 nM 6.42
CHEMBL185159 Ki = 503.0 nM 6.30
CHEMBL359569 Ki = 603.0 nM 6.22
CHEMBL184553 Ki = 653.0 nM 6.18
CHEMBL185321 Ki = 753.0 nM 6.12
CHEMBL184062 Ki = 754.0 nM 6.12
CHEMBL364875 Ki = 753.0 nM 6.12
CHEMBL184302 Ki = 804.0 nM 6.09
CHEMBL185279 Ki = 955.0 nM 6.02
CHEMBL365905 Ki = 1206.0 nM 5.92
CHEMBL184885 Ki = 1708.0 nM 5.77
CHEMBL363732 Ki = 1758.0 nM 5.75
CHEMBL185587 Ki = 2613.0 nM 5.58
CHEMBL182730 Ki = 3266.0 nM 5.49
CHEMBL184782 Ki = 3266.0 nM 5.49
CHEMBL365031 Ki = 3869.0 nM 5.41
CHEMBL362100 Ki > 5000.0 nM -
CHEMBL426434 Ki > 5000.0 nM -
CHEMBL184265 Ki > 5000.0 nM -
CHEMBL181807 Ki > 5000.0 nM -
CHEMBL363451 Ki > 5000.0 nM -
CHEMBL184942 Ki > 5000.0 nM -
CHEMBL183431 Ki > 5000.0 nM -
CHEMBL359625 Ki > 5000.0 nM -
CHEMBL185521 Ki > 5000.0 nM -
CHEMBL185397 Ki > 5000.0 nM -
CHEMBL364589 Ki > 5000.0 nM -
CHEMBL184889 Ki > 5000.0 nM -
CHEMBL183868 Ki > 5000.0 nM -
CHEMBL434348 Ki > 5000.0 nM -
CHEMBL185160 Ki > 5000.0 nM -
CHEMBL183828 Ki > 5000.0 nM -
CHEMBL184266 Ki > 5000.0 nM -
CHEMBL184200 Ki > 5000.0 nM -
CHEMBL184975 Ki > 5000.0 nM -
CHEMBL361376 Ki > 5000.0 nM -
CHEMBL363261 Ki > 5000.0 nM -