Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 20/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL23186834 | 0.86 | PTPN11 (0.50) | PTPN11KCNH2EGFR | |
| SCHEMBL25713879 | 0.82 | PTPN11 (0.71) | PTPN11KCNH2EGFR | |
| SCHEMBL19785580 | 0.81 | PTPN11 (0.72) | PTPN11KCNH2EGFR | |
| SCHEMBL19785390 | 0.76 | PTPN11 (0.46) | PTPN11KCNH2EGFR | |
| SCHEMBL25514711 | 0.74 | PTPN11 (0.56) | PTPN11KCNH2EGFR | |
| SCHEMBL21154348 | 0.72 | PTPN11 (0.67) | PTPN11KCNH2EGFR | |
| SCHEMBL19785090 | 0.72 | PTPN11 (0.58) | PTPN11KCNH2EGFR | |
| SCHEMBL24541893 | 0.71 | PTPN11 (0.37) | PTPN11KCNH2EGFR | |
| SCHEMBL19785349 | 0.70 | PTPN11 (0.41) | PTPN11KCNH2EGFR | |
| SCHEMBL31058247 | 0.70 | PTPN11 (0.38) | PTPN11KCNH2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018013597-A1 | 2,5-DISUBSTITUTED 3-METHYL PYRAZINES AND 2,5,6-TRISUBSTITUTED 3-METHYL PYRAZINES AS ALLOSTERIC SHP2 INHIBITORS | Revolution Medicines, Inc. (US) | 2018-01-18 | — | — | WO | disclosed |