Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 1.00 |
| ▸ | NPC1 | O15118 | 1/20 | 1.00 |
| ▸ | HTT | P42858 | 1/20 | 1.00 |
| ▸ | RAB9A | P51151 | 1/20 | 1.00 |
| ▸ | MAPT | P10636 | 5/20 | 0.66 |
| ▸ | MEN1 | O00255 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | POLB | P06746 | 1/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | XBP1 | P17861 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.63 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | NCOA3 | Q9Y6Q9 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21858367 | 1.00 | ALDH1A1 (1.00) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL16566488 | 0.89 | ALDH1A1 (0.79) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL31388374 | 0.88 | ALDH1A1 (0.82) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL5454021 | 0.87 | ALDH1A1 (0.77) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL15840633 | 0.84 | ALDH1A1 (0.71) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL5446693 | 0.82 | MAPK1 (0.75) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL4342059 | 0.82 | ALDH1A1 (0.69) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL4346849 | 0.81 | ALDH1A1 (0.68) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL11007347 | 0.80 | ALDH1A1 (0.72) | ALDH1A1NPC1HTTRAB9AMAPT | |
| SCHEMBL5081276 | 0.80 | NOX1 (0.85) | ALDH1A1NPC1HTTRAB9AMAPT |
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-113271941-B | Urea derivatives for the treatment and/or prophylaxis of cancer | 法国国家科学研究中心 | 2024-09-20 | — | — | CN | disclosed |