Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23326667 | 0.77 | CYP2D6 (0.41) | GABRA1GABRG2GABRB3 | |
| SCHEMBL23326669 | 0.77 | CYP2D6 (0.41) | GABRA1GABRG2GABRB3 | |
| SCHEMBL23326785 | 0.74 | — | — | |
| SCHEMBL23326788 | 0.74 | — | — | |
| SCHEMBL29861351 | 0.68 | — | — | |
| SCHEMBL23326550 | 0.68 | — | — | |
| SCHEMBL23344919 | 0.68 | CA2 (0.38) | GABRA1GABRG2GABRB3 | |
| SCHEMBL16252302 | 0.66 | MAPKAPK2 (0.43) | — | |
| SCHEMBL19289949 | 0.66 | MAPKAPK2 (0.43) | — | |
| SCHEMBL23326844 | 0.66 | KMT2A (0.36) | GABRA1GABRG2GABRB3 |
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 |