Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | NPR3 | P17342 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SLC26A6 | Q9BXS9 | 1/20 | 0.37 |
| ▸ | KCNH3 | Q9ULD8 | 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 | |
|---|---|---|---|---|
| SCHEMBL6528195 | 1.00 | ANPEP (0.43) | ANPEPTP53MEN1KMT2ATAS1R3 | |
| SCHEMBL6530303 | 0.89 | VNN1 (0.44) | ANPEPTAS1R3TAS1R1CYP2C9NPR3 | |
| SCHEMBL6529952 | 0.79 | NPR3 (0.42) | TP53MEN1KMT2ATAS1R3TAS1R1 | |
| SCHEMBL6529959 | 0.79 | NPR3 (0.42) | TP53MEN1KMT2ATAS1R3TAS1R1 | |
| SCHEMBL6530426 | 0.78 | ALDH1A1 (0.47) | TP53CYP2C9CYP2C19CTSKCTSS | |
| SCHEMBL6530423 | 0.78 | ALDH1A1 (0.47) | TP53CYP2C9CYP2C19CTSKCTSS | |
| SCHEMBL6529224 | 0.78 | NPR3 (0.56) | ANPEPMEN1KMT2ATAS1R3TAS1R1 | |
| SCHEMBL8298689 | 0.76 | CYP2C9 (0.44) | TP53TAS1R3TAS1R1CYP2C9NPR3 | |
| SCHEMBL6528805 | 0.76 | CYP2C9 (0.44) | TP53TAS1R3TAS1R1CYP2C9NPR3 | |
| SCHEMBL6530084 | 0.76 | RORC (0.45) | CYP2C9CYP2C19CTSKKCNH3 |
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 |