Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 4/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.56 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.39 |
| ▸ | CASR | P41180 | 2/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 3/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5792113 | 0.76 | GHSR (0.59) | GHSRCYP2D6KCNH2CASRCYP3A4 | |
| Iodide SCHEMBL5792092 | 0.75 | GHSR (0.55) | GHSRCYP2D6KCNH2CASRTDO2 | |
| SCHEMBL5792841 | 0.75 | GHSR (0.65) | GHSRCYP2D6HTR2CKCNH2AVPR1B | |
| SCHEMBL21632609 | 0.73 | GHSR (0.85) | GHSRCYP2D6HTR2CKCNH2AVPR1B | |
| SCHEMBL21632610 | 0.73 | GHSR (0.85) | GHSRCYP2D6HTR2CKCNH2AVPR1B | |
| SCHEMBL5791517 | 0.72 | GHSR (0.75) | GHSRCYP2D6HTR2CKCNH2AVPR1B | |
| SCHEMBL5823984 | 0.72 | CYP2D6 (0.76) | GHSRCYP2D6HTR2CKCNH2AVPR1B | |
| SCHEMBL20528727 | 0.71 | GHSR (1.00) | GHSRCYP2D6HTR2CKCNH2AVPR1B | |
| SCHEMBL20528724 | 0.71 | GHSR (1.00) | GHSRCYP2D6HTR2CKCNH2AVPR1B | |
| SCHEMBL20528764 | 0.71 | CYP2D6 (1.00) | GHSRCYP2D6KCNH2CYP3A4 |
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-2006012577-A2 | QUINAZOLINONE DERIVATIVES USEFUL FOR THE REGULATION OF GLUCOSE HOMEOSTASIS AND FOOD INTAKE | BAYER PHARMACEUTICALS CORPORATION (US) | 2006-02-02 | — | — | WO | disclosed |