Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL11242858 | 0.89 | ALDH1A1 (0.37) | ALDH1A1POLBCHRM2CHRM4CHRM1 | |
| SCHEMBL2180524 | 0.81 | GAA (0.51) | ALDH1A1POLBGAACHRM1THRB | |
| SCHEMBL11239874 | 0.76 | GAA (0.33) | GAACHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL11239890 | 0.76 | GAA (0.33) | GAACHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL27482014 | 0.75 | SMN1; SMN2 (0.54) | ALDH1A1POLBGAACHRM2CHRM1 | |
| SCHEMBL14243237 | 0.74 | ALDH1A1 (0.49) | ALDH1A1POLBGAACHRM2CHRM4 | |
| SCHEMBL22875112 | 0.74 | GAA (0.44) | ALDH1A1POLBGAACHRM2CHRM4 | |
| SCHEMBL2251940 | 0.73 | RECQL (0.50) | ALDH1A1CHRM2CHRM1CHRM3THRB | |
| SCHEMBL14401934 | 0.73 | RECQL (0.50) | ALDH1A1CHRM2CHRM1CHRM3THRB | |
| SCHEMBL17141113 | 0.73 | ALOX5 (0.39) | ALDH1A1POLBGAACHRM4CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4320137-A | Derivatives of perhydro-aza-heterocycles | CIBA-GEIGY CORPORATION (US) | 1982-03-16 | — | — | US | disclosed |
| US-4246269-A | Antidepressant piperidinones | CIBA-GEIGY CORPORATION (US) | 1981-01-20 | — | — | US | disclosed |
| US-4160837-A | ANTIDEPRESSANTS | CIBA-GEIGY CORPORATION (US) | 1979-07-10 | — | — | US | disclosed |