Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RIOK2 | Q9BVS4 | 4/20 | 0.38 |
| ▸ | GSK3A | P49840 | 3/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | PAK4 | O96013 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13443769 | 0.79 | TRPA1 (0.49) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL10057582 | 0.79 | CYP2A6 (0.50) | TRPA1ACHEL3MBTL1GSK3AAURKA | |
| SCHEMBL31255993 | 0.79 | TRPA1 (0.44) | TRPA1ACHEL3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL10024935 | 0.79 | LMNA (0.41) | TRPA1ACHEL3MBTL1MAPTGSK3A | |
| SCHEMBL6382617 | 0.79 | TRPA1 (0.44) | TRPA1ACHEL3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL6389633 | 0.79 | TRPA1 (0.62) | TRPA1ACHECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL113390 | 0.77 | TRPA1 (0.43) | TRPA1L3MBTL1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL18318359 | 0.77 | PLAU (0.47) | TRPA1ACHEL3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL22170802 | 0.77 | LMNA (0.40) | ACHEL3MBTL1CYP3A4MAPTGSK3A | |
| SCHEMBL15195532 | 0.77 | TNF (0.46) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4215525-A1 | PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF | Zhejiang Hisun Pharmaceutical Co., Ltd. (CN) | 2023-07-26 | — | — | EP | disclosed |
| EP-2033654-B1 | Process for resolving a mixture of alkyl ester enantiomers using an enzyme | BRISTOL MYERS SQUIBB CO (US) | 2012-05-16 | — | — | EP | disclosed |