Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30723310 | 0.90 | RAB9A (0.40) | RAB9ANPC1HRH3SMN1; SMN2RXFP1 | |
| SCHEMBL30723316 | 0.89 | ALDH1A1 (0.41) | RAB9ANPC1HRH3SMN1; SMN2LMNA | |
| SCHEMBL30723304 | 0.88 | RXFP1 (0.39) | RAB9ANPC1HRH3SMN1; SMN2RXFP1 | |
| SCHEMBL30723334 | 0.84 | BCHE (0.39) | RAB9ANPC1SMN1; SMN2L3MBTL1LMNA | |
| SCHEMBL30723312 | 0.84 | SMN1; SMN2 (0.39) | RAB9ANPC1HRH3SMN1; SMN2RXFP1 | |
| SCHEMBL30723308 | 0.83 | GAA (0.39) | HRH3ALDH1A1GAAKDM4EKCNH2 | |
| SCHEMBL30723326 | 0.82 | BCHE (0.37) | RAB9ANPC1HRH3SMN1; SMN2RXFP1 | |
| SCHEMBL30723300 | 0.82 | HTR7 (0.37) | RAB9ANPC1L3MBTL1ALDH1A1HTR7 | |
| SCHEMBL29152966 | 0.80 | ACHE (0.44) | RAB9ANPC1SMN1; SMN2LMNAHTR7 | |
| SCHEMBL30723328 | 0.80 | HRH3 (0.38) | HRH3L3MBTL1GAADRD2HTR2A |
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-117486887-A | Polycyclic pyrimidine-4-ketone compound and preparation method and application thereof | 昆明学院 | 2024-02-02 | — | — | CN | disclosed |