Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL29122705 | 0.90 | MAOB (0.37) | MAOBTP53POLBMAPTADORA2A | |
| SCHEMBL30525254 | 0.88 | ADORA2A (0.41) | MAOBADORA2A | |
| SCHEMBL29122943 | 0.85 | ADORA2A (0.39) | MAOBADORA2AATM | |
| SCHEMBL29123169 | 0.85 | TP53 (0.50) | MAOBTP53POLBMAPTADORA2A | |
| SCHEMBL30525245 | 0.81 | MDM2 (0.44) | — | |
| SCHEMBL29122666 | 0.81 | MAOB (0.37) | MAOB | |
| SCHEMBL29123157 | 0.80 | MAOB (0.38) | MAOBTP53POLBMAPTATM | |
| SCHEMBL30525256 | 0.80 | MAOB (0.40) | MAOB | |
| SCHEMBL29122912 | 0.78 | MAOB (0.41) | MAOBTP53POLBMAPTATM | |
| SCHEMBL30525257 | 0.78 | MAOB (0.37) | MAOBATM |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| CN-116535397-A | Isobenzofuran-1 (3H) -one compound, preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2023-08-04 | — | — | CN | disclosed |