Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.30 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL253297 | 0.98 | — | — | |
| SCHEMBL1778280 | 0.77 | HSP90AA1 (0.33) | HSP90AA1HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL27671906 | 0.77 | NAPRT (0.45) | CYP1A2CYP3A4CYP2C9CYP2C19VNN1 | |
| SCHEMBL27650067 | 0.76 | — | — | |
| SCHEMBL30704808 | 0.76 | — | — | |
| SCHEMBL7374771 | 0.76 | — | — | |
| SCHEMBL1920222 | 0.76 | — | — | |
| Water SCHEMBL27651496 | 0.75 | NAPRT (0.44) | CYP1A2CYP3A4CYP2C9CYP2C19VNN1 | |
| SCHEMBL11788505 | 0.74 | HSP90AA1 (0.34) | HSP90AA1HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL980114 | 0.73 | — | — |
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-109965339-A | Tobacco processing | 英美烟草(投资)有限公司 | 2019-07-05 | — | — | CN | disclosed |
| CN-105848502-B | tobacco processing method | 英美烟草(投资)有限公司 | 2019-04-16 | — | — | CN | disclosed |
| CN-105848502-A | Tobacco treatment | 英美烟草(投资)有限公司 | 2016-08-10 | — | — | CN | disclosed |