Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | AOC2 | O75106 | 13/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 6/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21865064 | 0.83 | KDM4E (0.38) | AOC2 | |
| SCHEMBL16766630 | 0.79 | MAOB (0.64) | MAOBAOC2DAOMAOA | |
| SCHEMBL16766826 | 0.79 | MAOB (0.64) | MAOBAOC2DAOMAOA | |
| SCHEMBL16766628 | 0.79 | MAOB (0.64) | MAOBAOC2DAOMAOA | |
| Hydrochloric Acid SCHEMBL15527731 | 0.78 | MAOB (0.62) | MAOBAOC2AOC3DAOMAOA | |
| Hydrochloric Acid SCHEMBL16766098 | 0.78 | MAOB (0.62) | MAOBAOC2AOC3DAOMAOA | |
| Hydrochloric Acid SCHEMBL15527728 | 0.78 | MAOB (0.62) | MAOBAOC2AOC3DAOMAOA | |
| SCHEMBL21864806 | 0.77 | AOC2 (0.47) | MAOBAOC2AOC3DAOMAOA | |
| SCHEMBL21865012 | 0.76 | AOC2 (0.48) | MAOBAOC2AOC3DAOMAOA | |
| SCHEMBL21865042 | 0.75 | AOC2 (0.50) | MAOBAOC2AOC3DAOMAOA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020063854-A1 | QUINOLINE-BASED DERIVATIVES AS VAP-1 INHIBITORS | 南京明德新药研发有限公司 | 2020-04-02 | — | — | WO | disclosed |