Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B2 | P37059 | 3/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 5/20 | 0.36 |
| ▸ | SLC2A4 | P14672 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | TSPO | P30536 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.35 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.34 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7704946 | 0.92 | ALDH1A1 (0.38) | SLC2A1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7704910 | 0.90 | HDAC1 (0.45) | HDAC3HDAC1HDAC2NCOR2MEN1 | |
| SCHEMBL7711248 | 0.88 | RIPK1 (0.37) | HDAC3HDAC1HDAC2NCOR2TSPO | |
| SCHEMBL7704902 | 0.88 | RIPK1 (0.37) | SLC2A1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7711186 | 0.87 | NR3C2 (0.41) | SLC2A1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7711366 | 0.87 | HDAC1 (0.37) | HDAC3HDAC1HDAC2NCOR2ALDH1A1 | |
| SCHEMBL7708189 | 0.87 | HDAC3 (0.37) | HDAC3HDAC1HDAC2NCOR2MEN1 | |
| SCHEMBL7711360 | 0.86 | TRPM8 (0.36) | SLC2A1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL7713369 | 0.85 | HDAC1 (0.34) | HDAC3HDAC1HDAC2NCOR2ALOX15 | |
| SCHEMBL6302692 | 0.85 | BRD4 (0.38) | HDAC3HDAC1HDAC2NCOR2PTGES |
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-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |