Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 4/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21889186 | 1.00 | AOC3 (0.44) | AOC3MAOBKDM4EMGLLCA12 | |
| SCHEMBL23329639 | 0.87 | MAOB (0.46) | AOC3MAOBCA12CA1CA2 | |
| SCHEMBL28666101 | 0.87 | AOC3 (0.39) | AOC3MAOBCA12CA1CA2 | |
| SCHEMBL28668740 | 0.87 | AOC3 (0.39) | AOC3MAOBCA12CA1CA2 | |
| SCHEMBL28646684 | 0.87 | AOC3 (0.39) | AOC3MAOBCA12CA1CA2 | |
| SCHEMBL24147557 | 0.85 | TRPA1 (0.45) | AOC3MAOB | |
| SCHEMBL24147442 | 0.85 | MRGPRX4 (0.41) | AOC3MAOBMAPTPOLBHPGD | |
| SCHEMBL24147661 | 0.85 | EGLN2 (0.41) | ABCB1 | |
| SCHEMBL21889843 | 0.85 | MAOB (0.45) | AOC3MAOBKDM4ECA12CA1 | |
| SCHEMBL21780054 | 0.85 | AOC3 (0.50) | AOC3MAOBCA12CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110914234-B | Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine | 广东东阳光药业有限公司 | 2023-06-23 | — | — | CN | disclosed |
| CN-115916337-A | Haloallylamine diamine oxidase inhibitors | 法玛西斯有限公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-110914234-A | Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine | 广东东阳光药业有限公司 | 2020-03-24 | — | — | CN | disclosed |