Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 1.00 |
| ▸ | MAOB | P27338 | 2/20 | 1.00 |
| ▸ | ELANE | P08246 | 6/20 | 0.86 |
| ▸ | STK17B | O94768 | 6/20 | 0.76 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.72 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.72 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.72 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.72 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.72 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.72 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.72 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.72 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.72 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.72 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.72 |
| ▸ | ACHE | P22303 | 2/20 | 0.67 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | RECQL | P46063 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL19462898 | 1.00 | MAOA (1.00) | MAOAMAOBELANESTK17BHDAC3 | |
| SCHEMBL19499394 | 0.92 | STK17B (0.89) | MAOAMAOBELANESTK17BHDAC3 | |
| SCHEMBL19462733 | 0.92 | STK17B (0.89) | MAOAMAOBELANESTK17BHDAC3 | |
| (Z)-Aurone SCHEMBL305100 | 0.86 | STK17B (1.00) | MAOAMAOBELANESTK17BHDAC3 | |
| (Z)-Aurone SCHEMBL31266594 | 0.86 | STK17B (1.00) | MAOAMAOBELANESTK17BHDAC3 | |
| (Z)-Aurone SCHEMBL29935711 | 0.86 | STK17B (1.00) | MAOAMAOBELANESTK17BHDAC3 | |
| (Z)-Aurone SCHEMBL13971324 | 0.86 | STK17B (1.00) | MAOAMAOBELANESTK17BHDAC3 | |
| (Z)-Aurone SCHEMBL305101 | 0.86 | STK17B (1.00) | MAOAMAOBELANESTK17BHDAC3 | |
| SCHEMBL21046443 | 0.84 | ELANE (0.76) | MAOAMAOBELANESTK17BHDAC3 | |
| SCHEMBL21082587 | 0.84 | STK17B (0.76) | MAOAMAOBELANESTK17BHDAC3 |
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-115028564-A | Synthetic method of pyrrole derivative | 安徽工程大学 | 2022-09-09 | — | — | CN | disclosed |