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Assay Detail

CHEMBL872347

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

Binding
Binding affinity towards (MMP-1) matrix metalloprotease-1
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Interstitial collagenase (CHEMBL332)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Receptor flexibility in de novo ligand design and docking.
Alberts IL, Todorov NP, Dean PM.
J Med Chem (2005) 48 : 6585 -6596
PubMed 16220975 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 20 7.58 8.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL198988 1 8.52
CHEMBL197685 1 8.52
CHEMBL199156 1 8.52
CHEMBL198664 1 8.52
CHEMBL194570 1 8.09
CHEMBL438261 1 8.09
CHEMBL383560 1 8.09
CHEMBL198377 1 8.09
CHEMBL83508 1 7.48
CHEMBL366010 1 7.48
CHEMBL198048 1 7.48
CHEMBL198662 1 7.48
CHEMBL370416 1 7.16
CHEMBL382535 1 7.16
CHEMBL195010 1 7.16
CHEMBL198369 1 7.16
CHEMBL372377 1 6.65
CHEMBL198393 1 6.65
CHEMBL197908 1 6.65
CHEMBL373285 1 6.65

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL198988 Ki = 3.0 nM 8.52
CHEMBL197685 Ki = 3.0 nM 8.52
CHEMBL199156 Ki = 3.0 nM 8.52
CHEMBL198664 Ki = 3.0 nM 8.52
CHEMBL194570 Ki = 8.2 nM 8.09
CHEMBL438261 Ki = 8.2 nM 8.09
CHEMBL383560 Ki = 8.2 nM 8.09
CHEMBL198377 Ki = 8.2 nM 8.09
CHEMBL83508 Ki = 33.0 nM 7.48
CHEMBL366010 Ki = 33.0 nM 7.48
CHEMBL198048 Ki = 33.0 nM 7.48
CHEMBL198662 Ki = 33.0 nM 7.48
CHEMBL370416 Ki = 70.0 nM 7.16
CHEMBL382535 Ki = 70.0 nM 7.16
CHEMBL195010 Ki = 70.0 nM 7.16
CHEMBL198369 Ki = 70.0 nM 7.16
CHEMBL372377 Ki = 224.0 nM 6.65
CHEMBL198393 Ki = 224.0 nM 6.65
CHEMBL197908 Ki = 224.0 nM 6.65
CHEMBL373285 Ki = 224.0 nM 6.65