Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.51 |
| ▸ | PDE4A | P27815 | 1/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.50 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | PTGES | O14684 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CASR | P41180 | 1/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.43 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.42 |
| ▸ | MAP1LC3B | Q9GZQ8 | 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 | |
|---|---|---|---|---|
| SCHEMBL6309834 | 0.93 | PTGES (0.50) | PDE4APDE4BPDE4CPDE4DPTGES | |
| SCHEMBL6308352 | 0.89 | PDE4A (0.59) | PDE4APDE4BPDE4CPDE4DCASR | |
| SCHEMBL6308313 | 0.84 | EGFR (0.69) | KIF11EGFRCASRALDH1A1SMN1; SMN2 | |
| SCHEMBL6307635 | 0.83 | EGFR (0.57) | KIF11PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6315148 | 0.82 | EGFR (0.66) | KIF11EGFRCASRALDH1A1SMN1; SMN2 | |
| SCHEMBL6308411 | 0.82 | DHFR (0.49) | PDE4APDE4BPDE4CPDE4DPTGES | |
| SCHEMBL6306950 | 0.81 | ALDH1A1 (0.59) | EGFRMAPTALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL6306949 | 0.81 | ALDH1A1 (0.59) | EGFRMAPTALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL6313867 | 0.80 | ALOX5AP (0.52) | KIF11EGFRCYP3A4TDP1MAP1LC3B | |
| SCHEMBL6308855 | 0.80 | EGFR (0.59) | EGFRCYP3A4CASRALDH1A1SMN1; SMN2 |
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-6890930-B1 | Quinazolinones | 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) | 2005-05-10 | — | — | US | disclosed |
| EP-1216235-A1 | QUINAZOLINONES | MERCK PATENT GmbH (DE) | 2002-06-26 | — | — | EP | disclosed |
| WO-2001023365-A1 | QUINAZOLINONES | MERCK PATENT GMBH (DE) | 2001-04-05 | — | — | WO | disclosed |