Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 3/20 | 0.50 |
| ▸ | MALT1 | Q9UDY8 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MERTK | Q12866 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29501931 | 1.00 | CTSK (0.50) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL17544472 | 0.87 | MALT1 (0.57) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL27819587 | 0.81 | CTSK (0.54) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL3451280 | 0.81 | CTSK (0.58) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL3807631 | 0.80 | MALT1 (0.50) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL31135484 | 0.80 | MERTK (0.54) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL13213387 | 0.80 | MALT1 (0.50) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL19174443 | 0.80 | CTSK (0.60) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL19462069 | 0.77 | MAPK1 (0.49) | CTSKMALT1CYP3A4CYP1A2CYP2D6 | |
| SCHEMBL12526894 | 0.77 | HRH3 (0.68) | CTSKMALT1CYP3A4CYP1A2CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114315834-B | Imidazolone derivatives and their use in medicine | 成都百裕制药股份有限公司 | 2024-01-05 | — | — | CN | disclosed |
| CN-113121538-B | Furan derivative and application thereof in medicine | 成都百裕制药股份有限公司 | 2023-04-21 | — | — | CN | disclosed |
| CN-114315834-A | Imidazolidinone derivatives and their use in medicaments | 成都百裕制药股份有限公司 | 2022-04-12 | — | — | CN | disclosed |