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Assay Detail

CHEMBL4017397

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

Binding
Inhibition of full length recombinant human MMP13 expressed in mouse NSO cells using varying levels of fTHP-15 as substrate preincubated for 30 mins followed by substrate addition measured immediately by Lineweaver-Burk plot analysis
7
Total Activities
7
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Collagenase 3 (CHEMBL280)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Based Design and Synthesis of Potent and Selective Matrix Metalloproteinase 13 Inhibitors.
Choi JY, Fuerst R, Knapinska AM, Taylor AB, Smith L, Cao X, Hart PJ, Fields GB, Roush WR.
J Med Chem (2017) 60 : 5816 -5825
PubMed 28653849 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 7 8.14 8.80

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4061792 1 8.80
CHEMBL4080520 1 8.77
CHEMBL4089861 1 8.74
CHEMBL4062836 1 8.64
CHEMBL4100008 1 8.04
CHEMBL4081997 1 7.87
CHEMBL1371684 1 6.10

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4061792 Ki = 1.6 nM 8.80
CHEMBL4080520 Ki = 1.7 nM 8.77
CHEMBL4089861 Ki = 1.8 nM 8.74
CHEMBL4062836 Ki = 2.3 nM 8.64
CHEMBL4100008 Ki = 9.2 nM 8.04
CHEMBL4081997 Ki = 13.5 nM 7.87
CHEMBL1371684 Ki = 800.0 nM 6.10