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Assay Detail

CHEMBL5118945

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

Binding
Inhibition of MMP-2 (unknown origin)
29
Total Activities
26
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

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

Target

72 kDa type IV collagenase (CHEMBL333)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Selective Inhibitors of Medium-Size S1' Pocket Matrix Metalloproteinases: A Stepping Stone of Future Drug Discovery.
Baidya SK, Banerjee S, Adhikari N, Jha T.
J Med Chem (2022) 65 : 10709 -10754
PubMed 35969157 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 7.98 10.30
Ki 12 7.54 9.66

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL473539 1 10.30
CHEMBL5174280 1 9.69
CHEMBL1801046 1 9.66
CHEMBL19611 ILOMASTAT 2.0 2 9.41
CHEMBL5177819 1 9.39
CHEMBL5205275 1 9.23
CHEMBL100570 1 8.42
CHEMBL40143 1 8.40
CHEMBL5187653 2 8.40
CHEMBL5205063 1 8.40
CHEMBL5206844 1 8.26
CHEMBL5172839 1 8.22
CHEMBL279785 MARIMASTAT 3.0 1 8.22
CHEMBL74539 1 7.96
CHEMBL85030 2 7.96
CHEMBL445971 1 7.80
CHEMBL483857 1 7.55
CHEMBL5175662 1 7.39
CHEMBL2107228 SOLIMASTAT 2.0 1 7.10
CHEMBL5175770 1 6.81
CHEMBL41943 1 6.75
CHEMBL485492 1 6.08
CHEMBL5184549 1 5.62
CHEMBL50228 1 5.09
CHEMBL178590 1 4.90
CHEMBL1200699 DOXYCYCLINE 4.0 1 4.25

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL473539 IC50 = 0.05 nM 10.30
CHEMBL5174280 IC50 = 0.204 nM 9.69
CHEMBL1801046 Ki = 0.22 nM 9.66
CHEMBL19611 ILOMASTAT Ki = 0.39 nM 9.41
CHEMBL5177819 IC50 = 0.41 nM 9.39
CHEMBL5205275 IC50 = 0.588 nM 9.23
CHEMBL19611 ILOMASTAT IC50 = 1.1 nM 8.96
CHEMBL100570 Ki = 3.8 nM 8.42
CHEMBL5205063 IC50 = 4.0 nM 8.40
CHEMBL5187653 Ki = 4.0 nM 8.40
CHEMBL40143 IC50 = 4.0 nM 8.40
CHEMBL5187653 IC50 = 5.0 nM 8.30
CHEMBL5206844 IC50 = 5.51 nM 8.26
CHEMBL279785 MARIMASTAT IC50 = 6.0 nM 8.22
CHEMBL5172839 IC50 = 6.0 nM 8.22
CHEMBL85030 IC50 = 11.0 nM 7.96
CHEMBL74539 Ki = 11.0 nM 7.96
CHEMBL445971 Ki = 16.0 nM 7.80
CHEMBL85030 Ki = 20.0 nM 7.70
CHEMBL483857 Ki = 28.0 nM 7.55
CHEMBL5175662 IC50 = 41.0 nM 7.39
CHEMBL2107228 SOLIMASTAT IC50 = 80.0 nM 7.10
CHEMBL5175770 Ki = 154.0 nM 6.81
CHEMBL41943 IC50 = 180.0 nM 6.75
CHEMBL485492 Ki = 840.0 nM 6.08
CHEMBL5184549 Ki = 2400.0 nM 5.62
CHEMBL50228 Ki = 8100.0 nM 5.09
CHEMBL178590 IC50 = 12500.0 nM 4.90
CHEMBL1200699 DOXYCYCLINE IC50 = 56000.0 nM 4.25