Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 4/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | KRAS | P01116 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | KIT | P10721 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19785447 | 0.77 | PTPN11 (0.43) | PTPN11EGFRKCNH2PIK3CAMTOR | |
| SCHEMBL25515166 | 0.76 | PTPN11 (0.53) | PTPN11EGFRKCNH2 | |
| SCHEMBL19785067 | 0.74 | PTPN11 (0.46) | PTPN11EGFRKCNH2PIK3CAMTOR | |
| SCHEMBL19785090 | 0.71 | PTPN11 (0.58) | PTPN11EGFRKCNH2 | |
| SCHEMBL23425262 | 0.71 | PTPN11 (0.51) | PTPN11EGFRKCNH2FFAR4KIT | |
| SCHEMBL19785078 | 0.71 | PTPN11 (0.51) | PTPN11EGFRKCNH2FFAR4 | |
| SCHEMBL23511001 | 0.70 | PTPN11 (0.60) | PTPN11EGFRKCNH2 | |
| SCHEMBL24282630 | 0.69 | PTPN11 (0.54) | PTPN11EGFRKCNH2 | |
| SCHEMBL21154820 | 0.69 | PTPN11 (0.49) | PTPN11EGFRKCNH2 | |
| SCHEMBL19785039 | 0.69 | PTPN11 (0.83) | PTPN11EGFRKCNH2 |
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 |