Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SYK | P43405 | 1/20 | 0.44 |
| ▸ | P2RY12 | Q9H244 | 14/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6059213 | 0.85 | CYP2C19 (0.41) | SYKP2RY12CYP2C9CYP2C19MAPK1 | |
| SCHEMBL6059031 | 0.82 | CYP2C9 (0.39) | SYKCYP2C9CYP2C19ALDH1A1MAPK1 | |
| SCHEMBL31458940 | 0.80 | TRPM8 (0.40) | SYKCYP2C19KMT2A | |
| SCHEMBL12991880 | 0.80 | P2RY12 (0.48) | P2RY12CYP2C9CYP2C19ALDH1A1MAPK1 | |
| SCHEMBL1187052 | 0.79 | CYP2C9 (0.47) | P2RY12CYP2C9CYP2C19ALDH1A1MAPK1 | |
| SCHEMBL2685700 | 0.78 | P2RY12 (0.40) | P2RY12ALDH1A1MAPK1 | |
| SCHEMBL16649767 | 0.77 | CYP2C19 (0.40) | SYKP2RY12CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL17986785 | 0.77 | ALDH1A1 (0.44) | P2RY12CYP2C9CYP2C19ALDH1A1MAPK1 | |
| SCHEMBL465766 | 0.77 | SYK (0.47) | SYKCYP2C9CYP2C19ALDH1A1MAPK1 | |
| SCHEMBL31453248 | 0.77 | SYK (0.36) | SYKCYP2C19ALDH1A1KMT2A |
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-7071175-B1 | Pyridine mercapto carboxylic acids as carboxypeptidase U inhibitors | ASTRAZENECA AB (SE) | 2006-07-04 | — | — | US | disclosed |
| EP-1180098-A1 | NEW COMPOUNDS | AstraZeneca AB (SE) | 2002-02-20 | — | — | EP | disclosed |
| WO-2000066557-A1 | NEW COMPOUNDS | ASTRAZENECA AB (SE) | 2000-11-09 | — | — | WO | disclosed |