Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 4/20 | 0.44 |
| ▸ | WNT3A | P56704 | 3/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11293448 | 0.84 | GSK3B (0.45) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL11287141 | 0.84 | NPC1 (0.44) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL11292813 | 0.74 | ALDH1A1 (0.49) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL11267020 | 0.66 | NPC1 (0.57) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL11586017 | 0.65 | ALDH1A1 (0.50) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL17595406 | 0.65 | ALDH1A1 (0.50) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL17596624 | 0.65 | NPC1 (0.43) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL9049816 | 0.65 | RAB9A (0.64) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL18437367 | 0.64 | ALDH1A1 (0.58) | ALDH1A1NPC1RAB9ALMNAPOLB | |
| SCHEMBL11407883 | 0.64 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0044705-A1 | Substituted pyrimidin-2-ones, the salts thereof, processes for their preparation, pharmaceutical compositions containing them and a method therefor | GLAXO GROUP LIMITED (GB) | 1982-01-27 | — | — | EP | disclosed |