Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21801234 | 1.00 | HDAC3 (0.40) | HDAC3HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL21801230 | 0.90 | CYP3A4 (0.41) | MAOBMAOA | |
| SCHEMBL21801243 | 0.90 | ABCG2 (0.41) | HDAC3HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL21801237 | 0.89 | CSNK2A2 (0.37) | — | |
| SCHEMBL30744121 | 0.86 | MAOB (0.42) | HDAC3HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL21801229 | 0.86 | MAOB (0.42) | HDAC3HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL21801126 | 0.83 | MAOB (0.42) | HDAC3HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL21801214 | 0.82 | CYP3A4 (0.44) | MAOBABCB1ABCG2ABCC1ALDH2 | |
| SCHEMBL21801226 | 0.82 | MAOB (0.41) | HDAC3HDAC4HDAC1HDAC2HDAC6 | |
| SCHEMBL21801085 | 0.81 | ALDH2 (0.41) | MAOBABCB1ABCG2ABCC1ALDH2 |
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-112601743-B | Flavone compounds for the treatment and prevention of hepatitis b virus diseases | 豪夫迈·罗氏有限公司 | 2023-12-19 | — | — | CN | disclosed |