Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | AKT2 | P31751 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 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 | |
|---|---|---|---|---|
| SCHEMBL7224641 | 0.69 | KDM4E (0.33) | AKT1AKT2 | |
| SCHEMBL6221427 | 0.66 | GABRA1 (0.34) | GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL5261894 | 0.66 | GABRA1 (0.59) | GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL7224848 | 0.66 | GABRG2 (0.43) | AKT1AKT2GABRA1GABRG2GABRB3 | |
| SCHEMBL6217604 | 0.66 | GABRA1 (0.34) | GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL6217979 | 0.66 | GABRA1 (0.34) | GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL31579337 | 0.65 | CNR2 (0.34) | AKT1AKT2 | |
| SCHEMBL28822458 | 0.64 | PIK3CD (0.34) | — | |
| SCHEMBL6221519 | 0.64 | GABRA1 (0.47) | GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL5771903 | 0.64 | GABRA1 (0.47) | GABRA1GABRG2GABRB3GABRA3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6642229-B2 | Treatment of adverse neurological conditions | MERCK SHARP & DOHME LTD. | 2003-11-04 | — | — | US | disclosed |