Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4227006 | 0.90 | CA2 (0.38) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL9373240 | 0.90 | ALDH1A1 (0.38) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL4220854 | 0.89 | ALDH1A1 (0.39) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL4226990 | 0.89 | ALDH1A1 (0.41) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL4225370 | 0.89 | PRKAB2 (0.42) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL4224280 | 0.89 | ALDH1A1 (0.41) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL4218710 | 0.89 | MEN1 (0.41) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL9446303 | 0.89 | ALDH1A1 (0.39) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL4226042 | 0.88 | ALDH1A1 (0.38) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 | |
| SCHEMBL4231318 | 0.88 | KMT2A (0.40) | ALDH1A1CYP2D6CYP3A4TSHRCYP2C9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0445026-B1 | Aminomethylpiperidine derivatives, their process for preparation and the pharmaceutical compositions containing them | ADIR (FR) | 1994-01-26 | — | — | EP | disclosed |
| US-5229399-A | Analgesics | ADIR ET COMPAGNIE (FR) | 1993-07-20 | — | — | US | disclosed |
| US-5229398-A | Analgesics | ADIR ET COMPAGNIE (FR) | 1993-07-20 | — | — | US | disclosed |
| US-5192775-A | Analgesics | ADIR ET COMPAGNIE (FR) | 1993-03-09 | — | — | US | disclosed |
| EP-0445026-A1 | Aminomethylpiperidine derivatives, their process for preparation and the pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1991-09-04 | — | — | EP | disclosed |