Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29893770 | 1.00 | HDAC4 (0.43) | HDAC4HDAC7HDAC5AURKAUSP2 | |
| SCHEMBL24110333 | 0.87 | TACR1 (0.45) | AURKAADRB2PNMTEPHX1NOS3 | |
| SCHEMBL29893620 | 0.86 | AURKA (0.40) | AURKAADRB2PNMTEPHX1OPRL1 | |
| SCHEMBL28889316 | 0.86 | AURKA (0.40) | AURKAADRB2PNMTEPHX1OPRL1 | |
| SCHEMBL28889280 | 0.86 | AURKA (0.40) | AURKAADRB2PNMTEPHX1NR3C2 | |
| SCHEMBL29893670 | 0.86 | AURKA (0.40) | AURKAADRB2PNMTEPHX1NR3C2 | |
| SCHEMBL28889226 | 0.86 | AURKA (0.42) | AURKAKMT2AADRB2PNMTEPHX1 | |
| SCHEMBL29893797 | 0.86 | AURKA (0.42) | AURKAKMT2AADRB2PNMTEPHX1 | |
| SCHEMBL28889259 | 0.85 | HDAC4 (0.42) | HDAC4HDAC7HDAC5AURKAUSP2 | |
| SCHEMBL28889273 | 0.85 | ADRB2 (0.40) | AURKAKMT2AADRB2EPHX1KCNN4 |
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-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 |