Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | MALT1 | Q9UDY8 | 3/20 | 0.36 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7172429 | 0.76 | LMNA (0.48) | ALDH1A1POLBMAPK1GFERMALT1 | |
| SCHEMBL7172425 | 0.76 | LMNA (0.48) | ALDH1A1POLBMAPK1GFERMALT1 | |
| SCHEMBL6288858 | 0.74 | ALDH1A1 (0.43) | ALDH1A1POLBMAPK1GFERMALT1 | |
| SCHEMBL11190181 | 0.72 | ALDH1A1 (0.48) | ALDH1A1RECQLCYP3A4CYP2C19 | |
| SCHEMBL6239764 | 0.72 | HSD11B1 (0.57) | ALDH1A1POLBMAPK1GFERHCAR2 | |
| SCHEMBL7170243 | 0.70 | PDE4B (0.53) | ALDH1A1POLBMAPK1GFERHPGD | |
| SCHEMBL13938809 | 0.69 | HSD11B1 (0.48) | ALDH1A1POLBMAPK1GFERMALT1 | |
| SCHEMBL7174936 | 0.68 | PDE4B (0.66) | ALDH1A1POLBMAPK1GFERHPGD | |
| SCHEMBL7175061 | 0.68 | PDE4B (0.66) | ALDH1A1POLBMAPK1GFERHPGD | |
| SCHEMBL3994121 | 0.68 | HSD11B1 (0.53) | ALDH1A1MALT1HCAR2UTS2R |
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 |
|---|---|---|---|---|---|---|---|
| US-6956055-B2 | Substituted γ-lactone compounds as NMDA-antagonists | GRUNENTHAL GMBH (DE) | 2005-10-18 | — | — | US | disclosed |