Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6059170 | 0.95 | NAMPT (0.43) | NAMPTHDAC1GRIN2BMKNK2KDM4E | |
| SCHEMBL7257280 | 0.90 | NAMPT (0.46) | NAMPTHDAC1GRIN2BMKNK2CYP17A1 | |
| SCHEMBL7379372 | 0.90 | NAMPT (0.41) | NAMPTHDAC1GRIN2BMKNK2KDM4E | |
| SCHEMBL7375395 | 0.88 | NAMPT (0.43) | NAMPTHDAC1GRIN2BMKNK2KDM4E | |
| SCHEMBL6059029 | 0.88 | NAMPT (0.40) | NAMPTHDAC1GRIN2BMKNK2KDM4E | |
| SCHEMBL5076532 | 0.88 | NAMPT (0.47) | NAMPTHDAC1GRIN2BCYP17A1PPARG | |
| SCHEMBL7384394 | 0.86 | NAMPT (0.42) | NAMPTHDAC1GRIN2BMKNK2KDM4E | |
| SCHEMBL7375295 | 0.86 | NAMPT (0.42) | NAMPTHDAC1GRIN2BMKNK2KDM4E | |
| SCHEMBL7260124 | 0.86 | NAMPT (0.44) | NAMPTHDAC1GRIN2BMKNK2CYP17A1 | |
| SCHEMBL6059138 | 0.85 | CPB2 (0.41) | NAMPTHDAC1GRIN2BMKNK2KDM4E |
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 |