Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.55 |
| ▸ | KIF11 | P52732 | 6/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.46 |
| ▸ | DPP4 | P27487 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | PIK3R2 | O00459 | 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 | |
|---|---|---|---|---|
| SCHEMBL6309836 | 0.93 | EGFR (0.46) | EGFRKIF11CYP3A4MAP1LC3BCYP2C19 | |
| SCHEMBL6309036 | 0.88 | ALDH1A1 (0.48) | SMN1; SMN2TDP1 | |
| SCHEMBL6313928 | 0.83 | DHFR (0.41) | KIF11CYP3A4MAP1LC3BCYP2C19KCNH2 | |
| SCHEMBL6313867 | 0.82 | ALOX5AP (0.52) | EGFRKIF11CYP3A4MAP1LC3BCYP2C19 | |
| SCHEMBL6313511 | 0.80 | LMNA (0.51) | CYP3A4ALOX5APDPP4NPSR1TDP1 | |
| SCHEMBL6314890 | 0.79 | EGFR (0.86) | EGFRSMN1; SMN2 | |
| SCHEMBL5878279 | 0.79 | CYP2D6 (0.45) | EGFRKIF11CYP3A4MAP1LC3BCYP2C19 | |
| SCHEMBL6314802 | 0.77 | EGFR (0.83) | EGFRSMN1; SMN2 | |
| SCHEMBL6307635 | 0.76 | EGFR (0.57) | EGFRKIF11CYP3A4MAP1LC3BCYP2C19 | |
| SCHEMBL6308902 | 0.76 | EGFR (0.64) | EGFRKIF11CYP3A4MAP1LC3BCYP2C19 |
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 |