Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL29123169 | 0.88 | TP53 (0.50) | MAOBCYP1A2MAPK1ATMTP53 | |
| SCHEMBL29122623 | 0.85 | CYP1A2 (0.39) | MAOBCYP1A2MAPK1ATM | |
| SCHEMBL29123312 | 0.85 | CYP1A2 (0.39) | MAOBCYP1A2MAPK1ATMTP53 | |
| SCHEMBL29123342 | 0.83 | MAOB (0.44) | MAOBMAPK1ATMTP53POLB | |
| SCHEMBL29122772 | 0.83 | MAOB (0.38) | MAOBCYP1A2MAPK1 | |
| SCHEMBL29123157 | 0.83 | MAOB (0.38) | MAOBCYP1A2MAPK1ATMTP53 | |
| SCHEMBL29122954 | 0.82 | ADORA2A (0.41) | MAOBCYP1A2MAPK1 | |
| SCHEMBL30779698 | 0.82 | MAPK1 (0.37) | MAOBCYP1A2MAPK1ATM | |
| SCHEMBL29123596 | 0.82 | MAPK1 (0.37) | MAOBCYP1A2MAPK1ATM | |
| SCHEMBL30779706 | 0.80 | ALDH1A1 (0.40) | MAOBATMPOLBLMNA |
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 |