Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 9/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30057055 | 1.00 | PKM (0.40) | PKMGRM5NAMPTAKR1C3CYP1A2 | |
| SCHEMBL27166028 | 0.83 | NAMPT (0.48) | GRM5NAMPTAKR1C3 | |
| SCHEMBL27166118 | 0.83 | GRM5 (0.35) | GRM5NAMPTAKR1C3 | |
| SCHEMBL30057114 | 0.83 | GRM5 (0.35) | GRM5NAMPTAKR1C3 | |
| SCHEMBL30056639 | 0.81 | GRM5 (0.37) | PKMGRM5AKR1C3CYP1A2CYP3A4 | |
| SCHEMBL27166102 | 0.81 | GRM5 (0.37) | PKMGRM5AKR1C3CYP1A2CYP3A4 | |
| SCHEMBL27166090 | 0.81 | NAMPT (0.38) | GRM5NAMPTAKR1C3CYP1A2 | |
| SCHEMBL29205133 | 0.80 | KMT2A (0.47) | PKMGRM5AKR1C3ALDH1A1L3MBTL1 | |
| SCHEMBL27166199 | 0.79 | PROKR1 (0.45) | NAMPT | |
| SCHEMBL30055604 | 0.77 | MGLL (0.45) | CYP1A2CYP3A4CYP2D6ALDH1A1L3MBTL1 |
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-4334289-A1 | NOVEL HETEROCYCLIC COMPOUNDS, COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF | Organon R&D Finland Ltd (FI) | 2024-03-13 | — | — | EP | disclosed |