Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.32 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28889345 | 0.85 | ADRB2 (0.37) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL28889282 | 0.85 | ALDH1A1 (0.40) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL28889321 | 0.85 | ADRB2 (0.41) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL28889353 | 0.81 | GAA (0.44) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL29894681 | 0.81 | GAA (0.44) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL28889240 | 0.81 | ADRB2 (0.38) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL24110401 | 0.80 | ALDH1A1 (0.47) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL30484313 | 0.79 | L3MBTL1 (0.44) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL28889197 | 0.78 | ADRB2 (0.38) | GAAALDH1A1ADRB2NOS3NOS2 | |
| SCHEMBL28889258 | 0.78 | ADRB2 (0.39) | GAAALDH1A1ADRB2NOS3NOS2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022222911-A1 | PYRIMIDONE COMPOUND AND USE THEREOF | 武汉人福创新药物研发中心有限公司 | 2022-10-27 | — | — | WO | disclosed |
| CN-115215862-A | Pyrimidone compounds and uses thereof | 武汉人福创新药物研发中心有限公司 | 2022-10-21 | — | — | CN | disclosed |