Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.56 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 3/20 | 0.38 |
| ▸ | PPARA | Q07869 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17512981 | 0.88 | CYP3A4 (0.74) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL3504292 | 0.84 | NAAA (0.44) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL25343206 | 0.82 | CYP3A4 (0.48) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL11251509 | 0.73 | CYP3A4 (0.74) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 | |
| Alaproclate SCHEMBL5784981 | 0.73 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 | |
| Alaproclate SCHEMBL29481071 | 0.73 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 | |
| (S)-Alaproclate SCHEMBL23928818 | 0.73 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL5144290 | 0.73 | NAAA (0.43) | CYP2D6CYP2C19CYP2C9MAPTPPARG | |
| Alaproclate SCHEMBL34357 | 0.73 | CYP3A4 (1.00) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL16248458 | 0.72 | GRIN2D (0.42) | CYP3A4CYP1A2CYP2D6CYP2C19CYP2C9 |
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-7803559-B1 | Protein aggregation regulators | THE REGENTS OF THE UNIVERSITY OF CA (US) | 2010-09-28 | — | — | US | disclosed |
| US-7803559-B1 | Protein aggregation regulators | THE REGENTS OF THE UNIVERSITY OF CA (US) | 2010-09-28 | — | — | US | disclosed |