Assay Detail
Binding
CHEMBL5145444
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Allosteric inhibition of wild-type human SHP2 (1 to 535 residues) using DiFMUP and 2p-IRS1 peptide as substrates preincubated for 1 hr and followed by substrate addition and measured by microplate reader method
57
Total Activities
57
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
Tyrosine-protein phosphatase non-receptor type 11 (CHEMBL3864) ↗| Type | SINGLE PROTEIN |
| Organism | Homo sapiens |
Publication
Structure-based design, synthesis and biological evaluation of aminopyrazines as highly potent, selective, and cellularly active allosteric SHP2 inhibitors.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 57 | 6.23 | 8.82 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4752026 | — | — | 1 | 8.82 |
| CHEMBL4650521 | BATOPROTAFIB | 2.0 | 1 | 7.96 |
| CHEMBL5191319 | — | — | 1 | 7.80 |
| CHEMBL4789106 | — | — | 1 | 7.64 |
| CHEMBL4476848 | — | — | 1 | 7.64 |
| CHEMBL4762625 | — | — | 1 | 7.60 |
| CHEMBL4439006 | — | — | 1 | 7.44 |
| CHEMBL5196225 | — | — | 1 | 7.23 |
| CHEMBL4060033 | — | — | 1 | 7.15 |
| CHEMBL5192102 | — | — | 1 | 7.10 |
| CHEMBL4746224 | — | — | 1 | 7.01 |
| CHEMBL5176754 | — | — | 1 | 6.96 |
| CHEMBL5169327 | — | — | 1 | 6.76 |
| CHEMBL5187708 | — | — | 1 | 6.75 |
| CHEMBL5196191 | — | — | 1 | 6.50 |
| CHEMBL5175853 | — | — | 1 | 6.37 |
| CHEMBL5194002 | — | — | 1 | 6.32 |
| CHEMBL5171642 | — | — | 1 | 6.16 |
| CHEMBL5194617 | — | — | 1 | 6.15 |
| CHEMBL5176429 | — | — | 1 | 6.13 |
| CHEMBL5189486 | — | — | 1 | 6.09 |
| CHEMBL5199730 | — | — | 1 | 6.07 |
| CHEMBL5182415 | — | — | 1 | 6.01 |
| CHEMBL5198900 | — | — | 1 | 5.79 |
| CHEMBL5193161 | — | — | 1 | 5.75 |
| CHEMBL5171622 | — | — | 1 | 5.69 |
| CHEMBL5196507 | — | — | 1 | 5.56 |
| CHEMBL5205572 | — | — | 1 | 5.42 |
| CHEMBL5202683 | — | — | 1 | 5.38 |
| CHEMBL5207855 | — | — | 1 | 5.25 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4752026 | — | IC50 | = | 1.5 | nM | 8.82 |
| CHEMBL4650521 | BATOPROTAFIB | IC50 | = | 11.0 | nM | 7.96 |
| CHEMBL5191319 | — | IC50 | = | 15.7 | nM | 7.80 |
| CHEMBL4789106 | — | IC50 | = | 23.0 | nM | 7.64 |
| CHEMBL4476848 | — | IC50 | = | 23.0 | nM | 7.64 |
| CHEMBL4762625 | — | IC50 | = | 25.0 | nM | 7.60 |
| CHEMBL4439006 | — | IC50 | = | 36.0 | nM | 7.44 |
| CHEMBL5196225 | — | IC50 | = | 59.0 | nM | 7.23 |
| CHEMBL4060033 | — | IC50 | = | 71.0 | nM | 7.15 |
| CHEMBL5192102 | — | IC50 | = | 79.0 | nM | 7.10 |
| CHEMBL4746224 | — | IC50 | = | 98.0 | nM | 7.01 |
| CHEMBL5176754 | — | IC50 | = | 110.0 | nM | 6.96 |
| CHEMBL5169327 | — | IC50 | = | 175.0 | nM | 6.76 |
| CHEMBL5187708 | — | IC50 | = | 178.0 | nM | 6.75 |
| CHEMBL5196191 | — | IC50 | = | 320.0 | nM | 6.50 |
| CHEMBL5175853 | — | IC50 | = | 425.0 | nM | 6.37 |
| CHEMBL5194002 | — | IC50 | = | 484.0 | nM | 6.32 |
| CHEMBL5171642 | — | IC50 | = | 695.0 | nM | 6.16 |
| CHEMBL5194617 | — | IC50 | = | 712.0 | nM | 6.15 |
| CHEMBL5176429 | — | IC50 | = | 747.0 | nM | 6.13 |
| CHEMBL5189486 | — | IC50 | = | 811.0 | nM | 6.09 |
| CHEMBL5199730 | — | IC50 | = | 858.0 | nM | 6.07 |
| CHEMBL5182415 | — | IC50 | = | 976.0 | nM | 6.01 |
| CHEMBL5198900 | — | IC50 | = | 1640.0 | nM | 5.79 |
| CHEMBL5193161 | — | IC50 | = | 1797.0 | nM | 5.75 |
| CHEMBL5171622 | — | IC50 | = | 2035.0 | nM | 5.69 |
| CHEMBL5196507 | — | IC50 | = | 2766.0 | nM | 5.56 |
| CHEMBL5205572 | — | IC50 | = | 3837.0 | nM | 5.42 |
| CHEMBL5202683 | — | IC50 | = | 4130.0 | nM | 5.38 |
| CHEMBL5207855 | — | IC50 | = | 5604.0 | nM | 5.25 |
| CHEMBL5178740 | — | IC50 | = | 5710.0 | nM | 5.24 |
| CHEMBL5197228 | — | IC50 | = | 6176.0 | nM | 5.21 |
| CHEMBL5193992 | — | IC50 | = | 9025.0 | nM | 5.04 |
| CHEMBL5169774 | — | IC50 | = | 9554.0 | nM | 5.02 |
| CHEMBL5208634 | — | IC50 | = | 9663.0 | nM | 5.01 |
| CHEMBL5205293 | — | IC50 | = | 10750.0 | nM | 4.97 |
| CHEMBL5171013 | — | IC50 | = | 13740.0 | nM | 4.86 |
| CHEMBL5193176 | — | IC50 | = | 14840.0 | nM | 4.83 |
| CHEMBL4796034 | — | IC50 | = | 60000.0 | nM | 4.22 |
| CHEMBL5172543 | — | IC50 | - | — | - | |
| CHEMBL5169790 | — | IC50 | - | — | - | |
| CHEMBL5171194 | — | IC50 | - | — | - | |
| CHEMBL5205466 | — | IC50 | - | — | - | |
| CHEMBL5195521 | — | IC50 | - | — | - | |
| CHEMBL5206494 | — | IC50 | - | — | - | |
| CHEMBL5194042 | — | IC50 | - | — | - | |
| CHEMBL5204990 | — | IC50 | - | — | - | |
| CHEMBL5194760 | — | IC50 | - | — | - | |
| CHEMBL5183685 | — | IC50 | - | — | - | |
| CHEMBL5197374 | — | IC50 | - | — | - |