Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | ITK | Q08881 | 1/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 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 | |
|---|---|---|---|---|
| SCHEMBL30370198 | 1.00 | PSEN1 (0.39) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL29016575 | 0.81 | MRGPRX4 (0.34) | CYP3A4LIPGSMN1; SMN2MAPTKMT2A | |
| SCHEMBL29016639 | 0.81 | CSNK1D (0.40) | CYP2C9CYP3A4SMN1; SMN2MAPTKMT2A | |
| SCHEMBL30370383 | 0.81 | CSNK1D (0.40) | CYP2C9CYP3A4SMN1; SMN2MAPTKMT2A | |
| SCHEMBL29016548 | 0.78 | KDM4E (0.50) | POLBCYP2C9CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL30370795 | 0.78 | KDM4E (0.50) | POLBCYP2C9CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL29016638 | 0.77 | GPR52 (0.43) | ALDH1A1LIPGSMN1; SMN2MAPTNPC1 | |
| SCHEMBL30370212 | 0.74 | APP (0.54) | POLBCYP2C9CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL29016610 | 0.74 | APP (0.54) | POLBCYP2C9CYP3A4ALDH1A1CYP2C19 | |
| SCHEMBL30370846 | 0.74 | CYP2C9 (0.45) | POLBCYP2C9CYP3A4ALDH1A1CYP2C19 |
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-108689942-B | Nitrogen-containing bicyclic compound, and preparation method and application thereof | 广东东阳光药业有限公司 | 2023-06-09 | — | — | CN | disclosed |