Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSD | A5PKW4 | 3/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 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 | |
|---|---|---|---|---|
| SCHEMBL23925514 | 0.89 | USP5 (0.42) | PSDPDE4APDE4CPDE4DADORA2A | |
| SCHEMBL23390224 | 0.86 | PSD (0.41) | PSDPDE4APDE4CPDE4DADORA2A | |
| SCHEMBL23390222 | 0.86 | PSD (0.41) | PSDPDE4APDE4CPDE4DADORA2A | |
| SCHEMBL23390278 | 0.86 | PSD (0.41) | PSDPDE4APDE4CPDE4DADORA2A | |
| Trifluoroacetic Acid SCHEMBL30254170 | 0.86 | PSD (0.39) | PSDPDE4APDE4CPDE4DADORA2A | |
| SCHEMBL25463185 | 0.83 | CYP3A4 (0.38) | PSDPDE4APDE4CPDE4DADORA2A | |
| SCHEMBL23951138 | 0.83 | PSD (0.39) | PSDPDE4APDE4CPDE4DADORA2A | |
| SCHEMBL23390221 | 0.83 | PSD (0.40) | PSDPDE4APDE4CPDE4DADORA2A | |
| SCHEMBL23390225 | 0.83 | PSD (0.40) | PSDPDE4APDE4CPDE4DADORA2A | |
| SCHEMBL30101948 | 0.83 | PSD (0.40) | PSDPDE4APDE4CPDE4DADORA2A |
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-115443276-A | Pyridopyrimidinone derivatives and their use as modulators of aromatic hydrocarbon receptors | 东亚ST株式会社 | 2022-12-06 | — | — | CN | claimed |
| CN-115443276-A | Pyridopyrimidinone derivatives and their use as modulators of aromatic hydrocarbon receptors | 东亚ST株式会社 | 2022-12-06 | — | — | CN | disclosed |