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Assay Detail

CHEMBL718926

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Binding
Inhibitory constant against matrix metalloprotease-2
40
Total Activities
40
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

A new concept for multidimensional selection of ligand conformations (MultiSelect) and multidimensional scoring (MultiScore) of protein-ligand binding affinities.
Terp GE, Johansen BN, Christensen IT, Jørgensen FS.
J Med Chem (2001) 44 : 2333 -2343
PubMed 11428927 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 40 9.36 11.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL306947 1 11.00
CHEMBL74040 1 11.00
CHEMBL306033 1 11.00
CHEMBL76158 1 11.00
CHEMBL264859 1 11.00
CHEMBL308533 1 11.00
CHEMBL306608 1 10.70
CHEMBL77057 1 10.70
CHEMBL77663 1 10.70
CHEMBL311397 1 10.52
CHEMBL422058 1 10.52
CHEMBL74308 1 10.52
CHEMBL77659 1 10.30
CHEMBL308511 1 10.22
CHEMBL310037 1 10.22
CHEMBL75403 1 10.21
CHEMBL312076 1 10.10
CHEMBL415074 1 10.00
CHEMBL73803 1 9.60
CHEMBL76519 1 9.52
CHEMBL77754 1 9.48
CHEMBL306256 1 9.23
CHEMBL78335 1 9.05
CHEMBL307365 1 9.00
CHEMBL420376 1 8.99
CHEMBL75148 1 8.93
CHEMBL309067 1 8.74
CHEMBL77808 1 8.65
CHEMBL76869 1 8.60
CHEMBL77956 1 8.51

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL306947 Ki = 0.01 nM 11.00
CHEMBL308533 Ki = 0.01 nM 11.00
CHEMBL264859 Ki = 0.01 nM 11.00
CHEMBL76158 Ki = 0.01 nM 11.00
CHEMBL74040 Ki = 0.01 nM 11.00
CHEMBL306033 Ki = 0.01 nM 11.00
CHEMBL306608 Ki = 0.02 nM 10.70
CHEMBL77057 Ki = 0.02 nM 10.70
CHEMBL77663 Ki = 0.02 nM 10.70
CHEMBL311397 Ki = 0.03 nM 10.52
CHEMBL422058 Ki = 0.03 nM 10.52
CHEMBL74308 Ki = 0.03 nM 10.52
CHEMBL77659 Ki = 0.05 nM 10.30
CHEMBL308511 Ki = 0.06 nM 10.22
CHEMBL310037 Ki = 0.06 nM 10.22
CHEMBL75403 Ki = 0.062 nM 10.21
CHEMBL312076 Ki = 0.08 nM 10.10
CHEMBL415074 Ki = 0.1 nM 10.00
CHEMBL73803 Ki = 0.254 nM 9.60
CHEMBL76519 Ki = 0.3 nM 9.52
CHEMBL77754 Ki = 0.33 nM 9.48
CHEMBL306256 Ki = 0.59 nM 9.23
CHEMBL78335 Ki = 0.9 nM 9.05
CHEMBL307365 Ki = 1.0 nM 9.00
CHEMBL420376 Ki = 1.03 nM 8.99
CHEMBL75148 Ki = 1.17 nM 8.93
CHEMBL309067 Ki = 1.83 nM 8.74
CHEMBL77808 Ki = 2.24 nM 8.65
CHEMBL76869 Ki = 2.5 nM 8.60
CHEMBL77956 Ki = 3.06 nM 8.51
CHEMBL306177 Ki = 3.82 nM 8.42
CHEMBL78047 Ki = 6.0 nM 8.22
CHEMBL432346 Ki = 6.4 nM 8.19
CHEMBL77461 Ki = 10.0 nM 8.00
CHEMBL307027 Ki = 10.3 nM 7.99
CHEMBL74977 Ki = 18.9 nM 7.72
CHEMBL307211 Ki = 46.5 nM 7.33
CHEMBL307207 Ki = 123.0 nM 6.91
CHEMBL91055 Ki = 210.0 nM 6.68
CHEMBL306779 Ki = 812.0 nM 6.09