Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.64 |
| ▸ | HTR2C | P28335 | 1/20 | 0.64 |
| ▸ | GHSR | Q92847 | 5/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | DRD4 | P21917 | 5/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | AVPR1B | P47901 | 5/20 | 0.43 |
| ▸ | CASR | P41180 | 1/20 | 0.42 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5792180 | 0.87 | CYP2D6 (0.48) | CYP2D6HTR2CGHSRKCNH2CYP3A4 | |
| SCHEMBL5822965 | 0.87 | GHSR (0.75) | CYP2D6HTR2CGHSRKCNH2CYP3A4 | |
| SCHEMBL5792841 | 0.82 | GHSR (0.65) | CYP2D6HTR2CGHSRKCNH2CYP3A4 | |
| SCHEMBL5791040 | 0.82 | CYP2D6 (0.60) | CYP2D6HTR2CGHSRKCNH2CYP3A4 | |
| SCHEMBL5794704 | 0.76 | CYP2D6 (0.55) | CYP2D6HTR2CGHSRKCNH2CYP3A4 | |
| SCHEMBL5793518 | 0.75 | CYP2D6 (0.71) | CYP2D6HTR2CGHSRKCNH2CYP3A4 | |
| SCHEMBL5792085 | 0.73 | CYP2D6 (0.75) | CYP2D6HTR2CGHSRKCNH2CYP3A4 | |
| SCHEMBL8327760 | 0.70 | DRD4 (0.60) | CYP2D6CYP3A4DRD4CYP1A2CYP2C9 | |
| SCHEMBL2187937 | 0.69 | DRD4 (0.48) | CYP2D6CYP3A4DRD4CYP1A2CYP2C9 | |
| SCHEMBL5823984 | 0.68 | CYP2D6 (0.76) | CYP2D6HTR2CGHSRKCNH2CYP3A4 |
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 |