Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | FDPS | P14324 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25971519 | 0.92 | SLC6A2 (0.44) | SLC6A2TAAR1FDPSCYP2C9CYP2C19 | |
| SCHEMBL11861949 | 0.88 | HRH1 (0.53) | SLC6A2TAAR1FDPSCYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL11843236 | 0.86 | HRH1 (0.51) | SLC6A2TAAR1FDPSCYP2C9CYP2C19 | |
| SCHEMBL21240025 | 0.81 | SLC6A4 (0.50) | SLC6A2FDPSCYP2C9CYP2C19CYP1A2 | |
| SCHEMBL1042587 | 0.80 | OPRL1 (0.53) | — | |
| SCHEMBL16047194 | 0.78 | SLC6A2 (0.59) | SLC6A2TAAR1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL9815734 | 0.76 | SLC6A2 (0.42) | SLC6A2TAAR1FDPSCYP2C9CYP2C19 | |
| SCHEMBL8669644 | 0.74 | MAPT (0.56) | SLC6A2CYP2C9CYP2C19CYP1A2LMNA | |
| SCHEMBL26326653 | 0.74 | CYP2D6 (0.46) | TAAR1CYP2D6MAPTCYP3A4TDP1 | |
| SCHEMBL19994167 | 0.74 | SLC6A2 (0.41) | SLC6A2TAAR1FDPSCYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023016459-A1 | NOVEL ORGANIC ALKOXIDE AGGLOMERATE, AND PREPARATION METHOD THEREFOR AND APPLICATION AND THEREOF | 上海科技大学 | 2023-02-16 | — | — | WO | disclosed |