Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.52 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.51 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 5/20 | 0.50 |
| ▸ | DRD4 | P21917 | 3/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | CNR1 | P21554 | 1/20 | 0.50 |
| ▸ | HTR7 | P34969 | 1/20 | 0.50 |
| ▸ | DRD1 | P21728 | 1/20 | 0.50 |
| ▸ | DRD5 | P21918 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL657632 | 1.00 | TP53 (0.59) | TP53NPC1RAB9AGPR84SLC5A1 | |
| SCHEMBL10559396 | 0.91 | NPC1 (0.67) | NPC1RAB9ASLC5A1SLC5A2HTR7 | |
| SCHEMBL11123550 | 0.91 | GPR84 (0.59) | NPC1RAB9AGPR84POLBMEN1 | |
| SCHEMBL11431321 | 0.84 | NPC1 (0.69) | TP53NPC1RAB9AGPR84SLC5A1 | |
| SCHEMBL27366629 | 0.83 | RAB9A (0.70) | NPC1RAB9AGPR84SLC5A1SLC5A2 | |
| SCHEMBL20262696 | 0.83 | NPC1 (0.56) | NPC1RAB9ASLC5A1SLC5A2DRD2 | |
| SCHEMBL6158144 | 0.83 | NPC1 (0.56) | NPC1RAB9ASLC5A1SLC5A2HTR7 | |
| SCHEMBL11612967 | 0.83 | HTR7 (0.59) | NPC1RAB9ASLC5A1SLC5A2HTR7 | |
| SCHEMBL3078714 | 0.82 | L3MBTL1 (0.68) | NPC1RAB9AGPR84MEN1KMT2A | |
| SCHEMBL659281 | 0.82 | NPC1 (0.59) | NPC1RAB9ASLC5A1SLC5A2MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |
| CN-1681763-A | Chemical compounds | ASTRAZENECA AB (SE) | 2005-10-12 | — | — | CN | disclosed |
| EP-1549600-A1 | KETONES | AstraZeneca AB (SE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004011410-A1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-02-05 | — | — | WO | disclosed |