Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | WNT3A | P56704 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6058862 | 1.00 | NAMPT (0.41) | NAMPTHDAC1NPSR1MKNK2GRIN2B | |
| SCHEMBL6059332 | 0.92 | NAMPT (0.40) | NAMPTHDAC1NPSR1MKNK2GRIN2B | |
| SCHEMBL6059113 | 0.91 | NAMPT (0.42) | NAMPTHDAC1NPSR1MKNK2GRIN2B | |
| SCHEMBL6059117 | 0.91 | NAMPT (0.42) | NAMPTHDAC1NPSR1MKNK2GRIN2B | |
| SCHEMBL3820976 | 0.84 | NAMPT (0.43) | NAMPTHDAC1NPSR1MKNK2GRIN2B | |
| SCHEMBL2871142 | 0.83 | NAMPT (0.46) | NAMPTHDAC1MKNK2GRIN2BKDM4E | |
| SCHEMBL6059329 | 0.81 | NAMPT (0.41) | NAMPTHDAC1NPSR1MKNK2GRIN2B | |
| Diethylamine SCHEMBL7380494 | 0.80 | NAMPT (0.41) | NAMPTHDAC1NPSR1MKNK2GRIN2B | |
| SCHEMBL949620 | 0.78 | NAMPT (0.48) | NAMPTHDAC1GRIN2BMAPTCYP17A1 | |
| SCHEMBL15354526 | 0.78 | NAMPT (0.50) | NAMPTHDAC1MKNK2GRIN2BCYP17A1 |
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 |