Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.38 |
| ▸ | NPR3 | P17342 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | GALR2 | O43603 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6507727 | 1.00 | CYP2C9 (0.43) | CYP2C9CYP2C19ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6515009 | 0.93 | ALDH1A1 (0.43) | CYP2C9CYP2C19ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6515005 | 0.93 | ALDH1A1 (0.43) | CYP2C9CYP2C19ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6528805 | 0.87 | CYP2C9 (0.44) | CYP2C9CYP2C19ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL8298689 | 0.87 | CYP2C9 (0.44) | CYP2C9CYP2C19ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6512117 | 0.85 | CTSK (0.38) | CYP2C9CYP2C19ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6512111 | 0.85 | CTSK (0.38) | CYP2C9CYP2C19ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL6510872 | 0.85 | NPR3 (0.44) | CYP2C9CYP2C19MAPTLMNASMN1; SMN2 | |
| SCHEMBL6510875 | 0.85 | NPR3 (0.44) | CYP2C9CYP2C19MAPTLMNASMN1; SMN2 | |
| SCHEMBL6530423 | 0.82 | ALDH1A1 (0.47) | CYP2C9CYP2C19ALDH1A1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005003103-A2 | 2, 4, 6-TRI-SUBSTITUTED 6-MEMBERED HETEROCYCLES AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | ASTRAZENECA AB (SE) | 2005-01-13 | — | — | WO | claimed |
| WO-2005003103-A2 | 2, 4, 6-TRI-SUBSTITUTED 6-MEMBERED HETEROCYCLES AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | ASTRAZENECA AB (SE) | 2005-01-13 | — | — | WO | disclosed |