Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | SORT1 | Q99523 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL24110333 | 0.86 | TACR1 (0.45) | ADRB2NOS3NOS2ALDH1A1AURKA | |
| SCHEMBL29893797 | 0.86 | AURKA (0.42) | ADRB2NOS3NOS2ALDH1A1L3MBTL1 | |
| SCHEMBL28889226 | 0.86 | AURKA (0.42) | ADRB2NOS3NOS2ALDH1A1L3MBTL1 | |
| SCHEMBL28889143 | 0.86 | ADRB2 (0.42) | ADRB2NOS3NOS2ALDH1A1GAA | |
| SCHEMBL28889273 | 0.82 | ADRB2 (0.40) | ADRB2NOS3NOS2ALDH1A1GAA | |
| SCHEMBL28889213 | 0.81 | ADRB2 (0.41) | ADRB2ALDH1A1GAAL3MBTL1ACACB | |
| SCHEMBL28889339 | 0.81 | ADRB2 (0.42) | ADRB2NOS3NOS2ALDH1A1GAA | |
| SCHEMBL28889325 | 0.81 | ADRB2 (0.42) | ADRB2NOS3NOS2ALDH1A1GAA | |
| SCHEMBL30637658 | 0.80 | S1PR1 (0.41) | ALDH1A1NR3C2ACACBMAPTMEN1 | |
| SCHEMBL24110332 | 0.80 | KCNA5 (0.43) | ADRB2AURKASORT1MEN1KMT2A |
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 |