Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | CSF1R | P07333 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.51 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.49 |
| ▸ | TDP2 | O95551 | 1/20 | 0.49 |
| ▸ | NSD2 | O96028 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | XBP1 | P17861 | 1/20 | 0.49 |
| ▸ | GALK1 | P51570 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2013824 | 0.88 | LMNA (0.43) | ALDH1A1NPSR1HTTRXFP1LMNA | |
| SCHEMBL31567894 | 0.82 | ALDH1A1 (0.58) | ALDH1A1NPSR1HTTRXFP1MAPT | |
| SCHEMBL31567903 | 0.79 | LMNA (0.72) | ALDH1A1NPSR1HTTRXFP1MAPT | |
| SCHEMBL31567898 | 0.79 | LMNA (0.72) | ALDH1A1NPSR1HTTRXFP1MAPT | |
| SCHEMBL10460377 | 0.79 | LMNA (0.58) | ALDH1A1NPSR1HTTRXFP1MAPT | |
| SCHEMBL31567904 | 0.77 | ALDH1A1 (0.62) | ALDH1A1NPSR1HTTRXFP1MAPT | |
| SCHEMBL1126706 | 0.77 | ALDH1A1 (0.62) | ALDH1A1NPSR1HTTRXFP1MAPT | |
| SCHEMBL31567905 | 0.77 | ALDH1A1 (0.62) | ALDH1A1NPSR1HTTRXFP1MAPT | |
| SCHEMBL8886057 | 0.76 | CSF1R (0.53) | ALDH1A1NPSR1HTTRXFP1MAPT | |
| SCHEMBL1127449 | 0.75 | ALDH1A1 (0.53) | ALDH1A1NPSR1HTTRXFP1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2513061-A1 | PYRIDONE DERIVATIVES AS NK3 ANTAGONISTS | H. Lundbeck A/S (DK) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011072691-A1 | PYRIDONE DERIVATIVES AS NK3 ANTAGONISTS | H. LUNDBECK A/S (DK) | 2011-06-23 | — | — | WO | disclosed |