Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | ANPEP | P15144 | 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 | |
|---|---|---|---|---|
| SCHEMBL9779595 | 0.81 | MEN1 (0.33) | MEN1ALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL9779514 | 0.80 | MEN1 (0.33) | MEN1ALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL23293009 | 0.75 | CYP2D6 (0.33) | CYP2C19 | |
| SCHEMBL9779398 | 0.74 | CHRM2 (0.46) | MEN1ALDH1A1KMT2ACYP2C9CYP2C19 | |
| SCHEMBL9779486 | 0.73 | CHRM1 (0.42) | ALDH1A1 | |
| SCHEMBL9779645 | 0.72 | CHRM1 (0.32) | — | |
| SCHEMBL27324948 | 0.71 | PAOX (0.39) | ALDH1A1PAOXANPEP | |
| SCHEMBL4322486 | 0.69 | — | — | |
| SCHEMBL16648848 | 0.69 | — | — | |
| SCHEMBL3064459 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4996201-A | Alzheimer's disease | WARNER-LAMBERT CO. (US) | 1991-02-26 | — | — | US | disclosed |
| EP-0411616-A1 | 4-(N-substituted amino)-2-butynyl-1-carbamates and thiocarbamates and derivatives thereof as centrally acting muscarinic agents | WARNER-LAMBERT COMPANY (US) | 1991-02-06 | — | — | EP | disclosed |