Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.35 |
| ▸ | PARP1 | P09874 | 3/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | OGA | O60502 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26302908 | 0.86 | HRH3 (0.33) | HDAC6HRH3OPRM1OGA | |
| SCHEMBL30703833 | 0.80 | HDAC6 (0.41) | HDAC6GSK3BL3MBTL1GRM5 | |
| SCHEMBL26301556 | 0.78 | HDAC6 (0.33) | HDAC6HRH3KCNH2GRM5 | |
| SCHEMBL26302907 | 0.77 | OPRM1 (0.31) | OPRM1 | |
| SCHEMBL26302883 | 0.77 | OPRM1 (0.31) | PARP1OPRM1 | |
| SCHEMBL26302880 | 0.77 | BMPR1B (0.33) | PARP1OPRM1 | |
| SCHEMBL23652806 | 0.76 | COMT (0.34) | HDAC6 | |
| SCHEMBL26870099 | 0.76 | HRH3 (0.33) | HRH3PARP1OPRM1 | |
| SCHEMBL26311217 | 0.76 | OPRM1 (0.33) | PARP1OPRM1 | |
| SCHEMBL26313023 | 0.75 | HDAC6 (0.41) | HDAC6 |
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-113072551-B | Nitrogen-containing biphenyl derivative inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2024-08-13 | — | — | CN | disclosed |