Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 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 | |
|---|---|---|---|---|
| SCHEMBL29123107 | 1.00 | KDM4C (0.36) | KDM4CMRGPRX4 | |
| SCHEMBL30779652 | 0.87 | MAOB (0.38) | KDM4CMRGPRX4 | |
| SCHEMBL29122510 | 0.87 | MAOB (0.38) | KDM4CMRGPRX4 | |
| SCHEMBL29122950 | 0.85 | DAO (0.39) | — | |
| SCHEMBL29123094 | 0.84 | MAOB (0.38) | — | |
| SCHEMBL30779741 | 0.83 | LTB4R (0.40) | — | |
| SCHEMBL29123271 | 0.83 | LTB4R (0.40) | — | |
| SCHEMBL29122608 | 0.77 | ADORA2A (0.45) | — | |
| SCHEMBL29123342 | 0.71 | MAOB (0.44) | — | |
| SCHEMBL29122746 | 0.71 | ATM (0.36) | — |
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 |