Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.43 |
| ▸ | HPGD | P15428 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 6/20 | 0.40 |
| ▸ | GAA | P10253 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.38 |
| ▸ | MEN1 | O00255 | 6/20 | 0.38 |
| ▸ | BLM | P54132 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.37 |
| ▸ | TUBB | P07437 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5878037 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL7539728 | 0.94 | ALDH1A1 (0.43) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL7539725 | 0.94 | ALDH1A1 (0.43) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL5877962 | 0.90 | ALDH1A1 (0.42) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL5877957 | 0.90 | ALDH1A1 (0.42) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL5877397 | 0.88 | MEN1 (0.50) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL5877390 | 0.88 | MEN1 (0.50) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL5877739 | 0.87 | KMT2A (0.40) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL5877746 | 0.87 | KMT2A (0.40) | ALDH1A1MAPTHPGDKDM4EHTT | |
| SCHEMBL5877029 | 0.87 | TUBB4A (0.51) | ALDH1A1MAPTKDM4ELMNARAB9A |
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 |