Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 20/20 | 0.75 |
| ▸ | KRAS | P01116 | 5/20 | 0.73 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.73 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.73 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.73 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.73 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.73 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.73 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.73 |
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 | |
|---|---|---|---|---|
| SCHEMBL29849386 | 1.00 | SOS1 (0.75) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL24671930 | 0.89 | SOS1 (0.63) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL29849038 | 0.88 | SOS1 (0.61) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL29849063 | 0.86 | SOS1 (0.73) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL24671924 | 0.86 | SOS1 (0.73) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL23520810 | 0.86 | SOS1 (1.00) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL23412809 | 0.85 | SOS1 (0.78) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL23412810 | 0.85 | SOS1 (0.78) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL23412811 | 0.85 | SOS1 (0.78) | SOS1KRASCYP3A4CYP2C8CYP2D6 | |
| SCHEMBL29723535 | 0.85 | SOS1 (0.78) | SOS1KRASCYP3A4CYP2C8CYP2D6 |
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-2022170802-A1 | PYRIMIDO-PYRIDONE DERIVATIVE AS SOS1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 苏州阿尔脉生物科技有限公司 | 2022-08-18 | — | — | WO | disclosed |