Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 8/20 | 0.72 |
| ▸ | MAPT | P10636 | 6/20 | 0.72 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.72 |
| ▸ | XDH | P47989 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 5/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.61 |
| ▸ | PDE4A | P27815 | 1/20 | 0.61 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.61 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.61 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.60 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | APP | P05067 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | BACE1 | P56817 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL29011898 | 0.88 | CTSL (0.68) | ABCG2MAPTTNFRSF1AXDHMEN1 | |
| SCHEMBL29011937 | 0.87 | MAPT (0.67) | ABCG2MAPTTNFRSF1AMEN1KMT2A | |
| SCHEMBL6724627 | 0.86 | ABCG2 (0.72) | ABCG2MAPTTNFRSF1AXDHMEN1 | |
| SCHEMBL6724630 | 0.86 | ABCG2 (0.72) | ABCG2MAPTTNFRSF1AXDHMEN1 | |
| SCHEMBL633046 | 0.84 | ABCG2 (0.97) | ABCG2MAPTTNFRSF1AXDHMEN1 | |
| Metochalcone SCHEMBL4957703 | 0.84 | ABCG2 (1.00) | ABCG2MAPTTNFRSF1AXDHMEN1 | |
| SCHEMBL633045 | 0.84 | ABCG2 (0.97) | ABCG2MAPTTNFRSF1AXDHMEN1 | |
| Metochalcone SCHEMBL309111 | 0.84 | ABCG2 (1.00) | ABCG2MAPTTNFRSF1AXDHMEN1 | |
| Metochalcone SCHEMBL29412185 | 0.84 | ABCG2 (1.00) | ABCG2MAPTTNFRSF1AXDHMEN1 | |
| Metochalcone SCHEMBL29412184 | 0.84 | ABCG2 (1.00) | ABCG2MAPTTNFRSF1AXDHMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116023247-A | 2-propylene-1 ketone compound and preparation method and application thereof | 暨南大学 | 2023-04-28 | — | — | CN | claimed |
| CN-116023247-A | 2-propylene-1 ketone compound and preparation method and application thereof | 暨南大学 | 2023-04-28 | — | — | CN | disclosed |