Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 2/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23442120 | 0.79 | ADRB2 (0.33) | ADRB2ADRB1 | |
| SCHEMBL29723343 | 0.79 | ADRB2 (0.33) | ADRB2ADRB1 | |
| SCHEMBL23412493 | 0.79 | ADRB2 (0.33) | ADRB2ADRB1 | |
| Hydrochloric Acid SCHEMBL26628800 | 0.78 | ALDH1A1 (0.33) | ADRB2 | |
| Hydrochloric Acid SCHEMBL26628805 | 0.78 | ALDH1A1 (0.33) | ADRB2 | |
| Hydrochloric Acid SCHEMBL30496914 | 0.78 | ALDH1A1 (0.33) | ADRB2 | |
| SCHEMBL25628423 | 0.77 | SOS1 (0.51) | KRASSOS1 | |
| SCHEMBL25628415 | 0.74 | ADRB1 (0.33) | ADRB2ADRB1 | |
| SCHEMBL13401017 | 0.73 | CYP3A4 (0.33) | — | |
| SCHEMBL25628203 | 0.71 | SOS1 (0.39) | KRASSOS1ADRB2ADRB1 |
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-2023098825-A1 | SOS1 INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF | 勤浩医药（苏州）有限公司 | 2023-06-08 | — | — | WO | disclosed |