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Assay Detail

CHEMBL4037092

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

Binding
Inhibition of human interstitial recombinant N-terminal MMP1 expressed in Escherichia coli BL21(DE3) using Mca-Pro-Leu-Gly-Leu-Dpa-Ala-Arg-NH2 as substrate after 20 to 30 mins by spectrofluorimetric 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

Interstitial collagenase (CHEMBL332)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Natural-Products-Inspired Use of the gem-Dimethyl Group in Medicinal Chemistry.
Talele TT.
J Med Chem (2018) 61 : 2166 -2210
PubMed 28850227 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 7 8.05 9.40

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4088630 1 9.40
CHEMBL140970 1 9.10
CHEMBL342210 1 8.72
CHEMBL115727 1 7.62
CHEMBL345054 1 7.21
CHEMBL4067375 1 7.19
CHEMBL333729 1 7.10

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4088630 IC50 = 0.4 nM 9.40
CHEMBL140970 IC50 = 0.8 nM 9.10
CHEMBL342210 IC50 = 1.9 nM 8.72
CHEMBL115727 IC50 = 24.0 nM 7.62
CHEMBL345054 IC50 = 62.0 nM 7.21
CHEMBL4067375 IC50 = 64.0 nM 7.19
CHEMBL333729 IC50 = 79.0 nM 7.10