Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | LMNA | P02545 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 6/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.47 |
| ▸ | RELA | Q04206 | 2/20 | 0.47 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | ERCC5 | P28715 | 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 | |
|---|---|---|---|---|
| SCHEMBL17595406 | 0.74 | ALDH1A1 (0.50) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL11586017 | 0.71 | ALDH1A1 (0.50) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL12181167 | 0.71 | ALDH1A1 (0.65) | NPC1RAB9ALMNAALDH1A1MEN1 | |
| SCHEMBL9049816 | 0.71 | RAB9A (0.64) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL18437367 | 0.70 | ALDH1A1 (0.58) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL2216212 | 0.69 | ALDH1A1 (1.00) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL711360 | 0.69 | RAB9A (0.75) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL12310969 | 0.69 | NPC1 (0.62) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL1515726 | 0.69 | NPC1 (0.62) | NPC1RAB9ALMNAALDH1A1POLB | |
| SCHEMBL17595806 | 0.69 | NPC1 (0.44) | NPC1RAB9ALMNAALDH1A1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |