Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 5/20 | 0.36 |
| ▸ | MAOA | P21397 | 4/20 | 0.36 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL29122772 | 0.90 | MAOB (0.38) | MAOBMAOAPTGER1 | |
| SCHEMBL29122950 | 0.86 | DAO (0.39) | DAOMAOBMAOA | |
| SCHEMBL29122705 | 0.86 | MAOB (0.37) | MAOBTP53POLBMAPT | |
| SCHEMBL29123157 | 0.85 | MAOB (0.38) | MAOBTP53POLBMAPT | |
| SCHEMBL30779652 | 0.85 | MAOB (0.38) | MAOB | |
| SCHEMBL29122510 | 0.85 | MAOB (0.38) | MAOB | |
| SCHEMBL30779700 | 0.85 | LTB4R (0.40) | — | |
| SCHEMBL29123532 | 0.85 | LTB4R (0.40) | — | |
| SCHEMBL29122734 | 0.84 | MDM2 (0.40) | MAOBPTGER1 | |
| SCHEMBL29123169 | 0.83 | TP53 (0.50) | MAOBPTGER1TP53POLBMAPT |
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-117186045-A | Isobenzofuran-1 (3H) -ketone TREK-1 inhibitor, preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2023-12-08 | — | — | CN | disclosed |