Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 14/20 | 0.42 |
| ▸ | VCP | P55072 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.39 |
| ▸ | NHERF1 | O14745 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6990232 | 0.88 | PYGL (0.42) | PYGLSMYD3HRH4NHERF1 | |
| SCHEMBL6984406 | 0.87 | CHRM1 (0.44) | PYGLSMYD3HRH4NHERF1 | |
| SCHEMBL6989019 | 0.77 | FAAH (0.42) | HRH3HTR4 | |
| SCHEMBL5868411 | 0.74 | PYGL (0.43) | PYGLSMYD3HRH4HRH3 | |
| SCHEMBL6987482 | 0.73 | SMYD3 (0.37) | VCPSMYD3HRH3HTR4 | |
| Trifluoroacetic Acid SCHEMBL5867893 | 0.72 | PYGL (0.44) | PYGLSMYD3 | |
| SCHEMBL6984041 | 0.69 | ROCK2 (0.43) | HRH3HTR4 | |
| SCHEMBL6987182 | 0.68 | FAAH (0.43) | HRH3HTR4 | |
| SCHEMBL6985512 | 0.68 | KDM4E (0.45) | SMYD3 | |
| Hydrochloric Acid SCHEMBL6984317 | 0.67 | ROCK2 (0.44) | HRH3HTR4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1289954-A1 | SERINE PROTEASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2003-03-12 | — | — | EP | disclosed |
| WO-2001096303-A1 | SERINE PROTEASE INHIBITORS | ELI LILLY AND COMPANY (US) | 2001-12-20 | — | — | WO | disclosed |