Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.61 |
| ▸ | POLB | P06746 | 4/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.54 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | F11 | P03951 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6313852 | 0.93 | EGFR (0.64) | EGFRPOLBRXFP1ABCC1MAPT | |
| SCHEMBL6315037 | 0.92 | POLB (0.54) | EGFRPOLBRXFP1ABCC1MAPT | |
| SCHEMBL6308934 | 0.88 | EGFR (0.64) | EGFRPOLBRXFP1ABCC1MAPT | |
| SCHEMBL6309730 | 0.87 | ALDH1A1 (0.59) | POLBRXFP1MAPTF11ALDH1A1 | |
| SCHEMBL6315683 | 0.86 | EGFR (0.69) | EGFRPOLBRXFP1MAPTCYP3A4 | |
| SCHEMBL6308755 | 0.86 | EGFR (0.56) | EGFRPOLBRXFP1ABCC1MAPT | |
| SCHEMBL6314802 | 0.85 | EGFR (0.83) | EGFRPOLBRXFP1MAPTTP53 | |
| SCHEMBL6308357 | 0.85 | EGFR (0.59) | EGFRPOLBRXFP1ABCC1MAPT | |
| SCHEMBL6314809 | 0.85 | F11 (0.63) | POLBRXFP1MAPTF11ALDH1A1 | |
| SCHEMBL6308080 | 0.85 | F11 (0.57) | EGFRPOLBRXFP1ABCC1MAPT |
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 |