Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.42 |
| ▸ | GHSR | Q92847 | 5/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.41 |
| ▸ | TUBB | P07437 | 1/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.41 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.41 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.41 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.41 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.41 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.41 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5877929 | 0.88 | CYP2D6 (0.42) | CYP2D6CYP3A4GHSRKCNH2ALOX5AP | |
| SCHEMBL5877630 | 0.87 | CYP2D6 (0.49) | CYP2D6DPP4CYP3A4GHSRTUBB4A | |
| SCHEMBL5877135 | 0.87 | ABCC1 (0.47) | CYP2D6LMNARECQLALDH1A1PLA2G1B | |
| SCHEMBL5877978 | 0.85 | AVPR1B (0.49) | CYP2D6GHSRKCNH2AVPR1BHRH3 | |
| SCHEMBL5877069 | 0.84 | F11 (0.49) | CYP2D6CYP3A4GHSRKCNH2AVPR1B | |
| SCHEMBL5877494 | 0.83 | GHSR (0.60) | CYP2D6DPP4CYP3A4ADORA3GHSR | |
| SCHEMBL5878279 | 0.83 | CYP2D6 (0.45) | CYP2D6DPP4CYP3A4GHSRKCNH2 | |
| SCHEMBL5876981 | 0.82 | F11 (0.52) | CYP2D6LMNAGHSRKCNH2AVPR1B | |
| SCHEMBL5877542 | 0.82 | F11 (0.46) | CYP2D6DPP4CYP3A4GHSRKCNH2 | |
| SCHEMBL5877712 | 0.82 | AVPR1B (0.51) | GHSRAVPR1B |
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 |