Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 10/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.57 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | AVPR1B | P47901 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | F11 | P03951 | 1/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5878151 | 0.91 | GHSR (0.50) | GHSRCYP2D6HTR2CKCNH2CYP3A4 | |
| SCHEMBL5877978 | 0.90 | AVPR1B (0.49) | GHSRCYP2D6KCNH2AVPR1BADRA1A | |
| SCHEMBL5877867 | 0.89 | GHSR (0.54) | GHSRCYP2D6HTR2CKCNH2CYP3A4 | |
| SCHEMBL5877069 | 0.88 | F11 (0.49) | GHSRCYP2D6HTR2CKCNH2CYP3A4 | |
| SCHEMBL5878205 | 0.87 | CYP2D6 (0.61) | GHSRCYP2D6HTR2CKCNH2CYP3A4 | |
| SCHEMBL5876981 | 0.87 | F11 (0.52) | GHSRCYP2D6KCNH2AVPR1BADRA1A | |
| SCHEMBL5877489 | 0.86 | ABCC1 (0.53) | GHSRCYP2D6HTR2CKCNH2CYP3A4 | |
| SCHEMBL5877542 | 0.86 | F11 (0.46) | GHSRCYP2D6HTR2CKCNH2CYP3A4 | |
| SCHEMBL5877712 | 0.86 | AVPR1B (0.51) | GHSRAVPR1BF11 | |
| SCHEMBL5877695 | 0.85 | AVPR1B (0.46) | GHSRKCNH2AVPR1BADRA1AHRH3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7060706-B1 | Quinazolinones | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2006-06-13 | — | — | US | disclosed |
| EP-1216233-A1 | QUINAZOLINONES | MERCK PATENT GmbH (DE) | 2002-06-26 | — | — | EP | disclosed |
| WO-2001023364-A1 | QUINAZOLINONES | MERCK PATENT GMBH (DE) | 2001-04-05 | — | — | WO | disclosed |