Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HK1 | P19367 | 1/20 | 0.39 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.39 |
| ▸ | PNP | P00491 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5877568 | 0.92 | F11 (0.46) | PDE4BABCC1MAP3K11CYP2D6GHSR | |
| SCHEMBL5877641 | 0.91 | ABCC1 (0.46) | PDE4BABCC1POLBMAP3K11MAPK1 | |
| SCHEMBL5877323 | 0.91 | SMN1; SMN2 (0.45) | PDE4BABCC1POLBMAP3K11KDM4E | |
| SCHEMBL5878318 | 0.90 | ABCC1 (0.54) | PDE4BABCC1POLBALDH1A1HPGD | |
| SCHEMBL5877963 | 0.89 | ALDH1A1 (0.47) | ABCC1POLBALDH1A1HPGDMAPK1 | |
| SCHEMBL5876953 | 0.89 | ABCC1 (0.50) | ABCC1ALDH1A1CYP2D6HTR2CMEN1 | |
| SCHEMBL5876985 | 0.87 | CRHR1 (0.44) | ABCC1POLBALDH1A1HPGDMAPK1 | |
| SCHEMBL5877811 | 0.87 | ABCC1 (0.46) | ABCC1TP53CYP2D6HTR2CKMT2A | |
| SCHEMBL5877862 | 0.86 | AVPR1B (0.46) | ABCC1MAPTLMNA | |
| SCHEMBL5877265 | 0.86 | ABCC1 (0.44) | ABCC1POLBALDH1A1HPGDMAPK1 |
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 |