Assay Detail
ADMET
CHEMBL4400459
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Inhibition of human recombinant N-terminal His-tagged and enterokinase cleavage site-fused KLK1 (19 to 262 residues) expressed in baculovirus infected Sf9 insect cells using R110 labelled GSK3162232A as substrate measured at 30 secs interval for 5 mins by FLINT assay
28
Total Activities
28
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Cell Type | Sf9 |
| Confidence | 9 — Direct single protein target |
| Curated By | Autocuration |
Publication
Design and development of a series of borocycles as selective, covalent kallikrein 5 inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 28 | 5.28 | 6.60 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4558285 | — | — | 1 | 6.60 |
| CHEMBL4447752 | — | — | 1 | 6.40 |
| CHEMBL4559317 | — | — | 1 | 6.30 |
| CHEMBL4535907 | — | — | 1 | 6.20 |
| CHEMBL4517343 | — | — | 1 | 5.80 |
| CHEMBL4465265 | — | — | 1 | 5.70 |
| CHEMBL4473412 | — | — | 1 | 5.30 |
| CHEMBL4446676 | — | — | 1 | 5.10 |
| CHEMBL4465992 | — | — | 1 | 5.00 |
| CHEMBL4458035 | — | — | 1 | 5.00 |
| CHEMBL4572808 | — | — | 1 | 4.60 |
| CHEMBL4579813 | — | — | 1 | 4.50 |
| CHEMBL4520761 | — | — | 1 | 4.40 |
| CHEMBL4440493 | — | — | 1 | 4.20 |
| CHEMBL4514992 | — | — | 1 | 4.10 |
| CHEMBL4456068 | — | — | 1 | - |
| CHEMBL4436048 | — | — | 1 | - |
| CHEMBL4460168 | — | — | 1 | - |
| CHEMBL4543039 | — | — | 1 | - |
| CHEMBL4464120 | — | — | 1 | - |
| CHEMBL4569255 | — | — | 1 | - |
| CHEMBL4473069 | — | — | 1 | - |
| CHEMBL4448315 | — | — | 1 | - |
| CHEMBL4536142 | — | — | 1 | - |
| CHEMBL4547455 | — | — | 1 | - |
| CHEMBL4461533 | — | — | 1 | - |
| CHEMBL4560975 | — | — | 1 | - |
| CHEMBL4458545 | — | — | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4558285 | — | IC50 | = | 251.19 | nM | 6.60 |
| CHEMBL4447752 | — | IC50 | = | 398.11 | nM | 6.40 |
| CHEMBL4559317 | — | IC50 | = | 501.19 | nM | 6.30 |
| CHEMBL4535907 | — | IC50 | = | 630.96 | nM | 6.20 |
| CHEMBL4517343 | — | IC50 | = | 1584.89 | nM | 5.80 |
| CHEMBL4465265 | — | IC50 | = | 1995.26 | nM | 5.70 |
| CHEMBL4473412 | — | IC50 | = | 5011.87 | nM | 5.30 |
| CHEMBL4446676 | — | IC50 | = | 7943.28 | nM | 5.10 |
| CHEMBL4465992 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL4458035 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL4572808 | — | IC50 | = | 25118.86 | nM | 4.60 |
| CHEMBL4579813 | — | IC50 | = | 31622.78 | nM | 4.50 |
| CHEMBL4520761 | — | IC50 | = | 39810.72 | nM | 4.40 |
| CHEMBL4440493 | — | IC50 | = | 63095.73 | nM | 4.20 |
| CHEMBL4514992 | — | IC50 | = | 79432.82 | nM | 4.10 |
| CHEMBL4456068 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL4436048 | — | IC50 | = | 316227.77 | nM | - |
| CHEMBL4460168 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL4543039 | — | IC50 | >= | 3981.07 | nM | - |
| CHEMBL4464120 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL4569255 | — | IC50 | = | 158489.32 | nM | - |
| CHEMBL4473069 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL4448315 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL4536142 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL4547455 | — | IC50 | > | 10000.0 | nM | - |
| CHEMBL4461533 | — | IC50 | >= | 6309.57 | nM | - |
| CHEMBL4560975 | — | IC50 | = | 501187.23 | nM | - |
| CHEMBL4458545 | — | IC50 | = | 158489.32 | nM | - |