Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | HPGD | P15428 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 9/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.47 |
| ▸ | POLB | P06746 | 7/20 | 0.47 |
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | BLM | P54132 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.44 |
| ▸ | TUBB | P07437 | 1/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6313482 | 1.00 | ALDH1A1 (0.48) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6313888 | 0.93 | ALDH1A1 (0.49) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6313885 | 0.93 | ALDH1A1 (0.49) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6306610 | 0.88 | KMT2A (0.49) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6306604 | 0.88 | KMT2A (0.49) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6306036 | 0.86 | MEN1 (0.57) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6306032 | 0.86 | MEN1 (0.57) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6313835 | 0.85 | KMT2A (0.47) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6313839 | 0.85 | KMT2A (0.47) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL6310500 | 0.84 | TUBB4A (0.61) | ALDH1A1MAPTKDM4ELMNAHTT |
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 |