Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.62 |
| ▸ | NAMPT | P43490 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.58 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.58 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.58 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.57 |
| ▸ | TRAP1 | Q12931 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | RECQL | P46063 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.55 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.55 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL13211911 | 0.89 | HTT (0.71) | NAMPTALDH1A1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL4167985 | 0.84 | NAMPT (0.64) | NAMPTALDH1A1HSP90B1TRAP1HPGD | |
| SCHEMBL1065004 | 0.83 | NAMPT (0.63) | NAMPTHSP90B1TRAP1HPGDHSP90AA1 | |
| SCHEMBL1304055 | 0.83 | HSP90B1 (0.63) | NAMPTHSP90B1TRAP1HPGDHSP90AA1 | |
| SCHEMBL12569373 | 0.81 | HPGD (0.64) | NAMPTALDH1A1HSP90B1TRAP1HTT | |
| SCHEMBL4155125 | 0.79 | NAMPT (0.59) | NAMPTALDH1A1HSP90B1TRAP1HPGD | |
| SCHEMBL10726712 | 0.78 | ALDH1A1 (0.84) | PKMALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL4557193 | 0.78 | ALDH1A1 (0.84) | PKMALDH1A1KMT2AMEN1HPGD | |
| SCHEMBL3417055 | 0.77 | TRAP1 (0.56) | NAMPTHSP90B1TRAP1KMT2ARECQL | |
| SCHEMBL17618301 | 0.77 | TRAP1 (0.65) | NAMPTALDH1A1HSP90B1TRAP1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-118496146-A | Preparation method of isoindoline diketone compound | 五邑大学 | 2024-08-16 | — | — | CN | disclosed |