Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 6/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28590451 | 1.00 | CA12 (0.34) | CA12CA9GAAHRH3MAOB | |
| SCHEMBL28590447 | 1.00 | CA12 (0.34) | CA12CA9GAAHRH3MAOB | |
| SCHEMBL29279612 | 0.89 | HRH3 (0.44) | GAAHRH3SIRT2MEN1MAPT | |
| SCHEMBL30731535 | 0.89 | HRH3 (0.44) | GAAHRH3SIRT2MEN1MAPT | |
| SCHEMBL28586497 | 0.88 | PARP10 (0.40) | GAAHRH3MAOBALDH1A1HPGD | |
| SCHEMBL28586495 | 0.88 | PARP10 (0.40) | GAAHRH3MAOBALDH1A1HPGD | |
| SCHEMBL29629333 | 0.88 | PARP10 (0.40) | GAAHRH3MAOBALDH1A1HPGD | |
| SCHEMBL28594858 | 0.85 | HDAC4 (0.39) | CA12CA9HRH3MAOBALDH1A1 | |
| SCHEMBL28594856 | 0.85 | HDAC4 (0.39) | CA12CA9HRH3MAOBALDH1A1 | |
| SCHEMBL29629338 | 0.85 | HDAC4 (0.39) | CA12CA9HRH3MAOBALDH1A1 |
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-112898259-B | Method for preparing 3-substituted chromanone through nonmetal catalytic hydrogenation | 中国科学院化学研究所 | 2022-05-17 | — | — | CN | disclosed |