Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.60 |
| ▸ | MAOA | P21397 | 2/20 | 0.60 |
| ▸ | ACHE | P22303 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 4/20 | 0.52 |
| ▸ | CA9 | Q16790 | 4/20 | 0.52 |
| ▸ | CA1 | P00915 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 3/20 | 0.52 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | APAF1 | O14727 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28902197 | 0.88 | MAOB (0.57) | MAOBMAOAACHECA12CA9 | |
| SCHEMBL30787461 | 0.83 | MAOB (0.67) | MAOBMAOACA12CA9CA1 | |
| SCHEMBL28902178 | 0.80 | MAOB (0.60) | MAOBMAOACA12CA9CA1 | |
| SCHEMBL28902182 | 0.80 | MAOB (0.74) | MAOBMAOACA12CA9CA1 | |
| SCHEMBL28902179 | 0.79 | MAOB (0.64) | MAOBMAOACA12CA9CA1 | |
| SCHEMBL28902181 | 0.77 | MAOB (0.56) | MAOBMAOACA12CA9CA1 | |
| SCHEMBL31744579 | 0.77 | PSMB5 (0.49) | MAOBMAOAACHECA12CA9 | |
| SCHEMBL30167103 | 0.76 | MAOB (0.79) | MAOBMAOACA12CA9CA1 | |
| SCHEMBL28902190 | 0.76 | MAOB (0.79) | MAOBMAOACA12CA9CA1 | |
| SCHEMBL28902167 | 0.76 | MAOB (0.69) | MAOBMAOACA12CA9CA1 |
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-117567419-A | Synthesis method of 3-amine methyl primary ketone derivative | 深圳职业技术大学 | 2024-02-20 | — | — | CN | disclosed |