Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2014199 | 0.86 | GAA (0.44) | KDM4ECYP1A2CYP2C9HPGDALDH1A1 | |
| SCHEMBL2035472 | 0.82 | GAA (0.50) | KDM4ECYP1A2CYP2C9HPGDALDH1A1 | |
| SCHEMBL9947695 | 0.81 | GAA (0.43) | KDM4ECYP1A2CYP2C9HPGDALDH1A1 | |
| SCHEMBL9948181 | 0.79 | GAA (0.48) | KDM4ECYP1A2CYP2C9HPGDALDH1A1 | |
| SCHEMBL23146873 | 0.78 | KDM4E (0.52) | KDM4EHPGDALDH1A1HSD17B10GAA | |
| SCHEMBL14138730 | 0.78 | HPGD (0.52) | KDM4ECYP1A2CYP2C9HPGDALDH1A1 | |
| SCHEMBL9947652 | 0.78 | GAA (0.47) | KDM4ECYP1A2CYP2C9HPGDALDH1A1 | |
| SCHEMBL9947824 | 0.78 | GAA (0.47) | KDM4ECYP1A2CYP2C9HPGDALDH1A1 | |
| SCHEMBL9947980 | 0.75 | TAAR1 (0.46) | KDM4ECYP1A2CYP2C9HPGDALDH1A1 | |
| SCHEMBL1718143 | 0.75 | GAA (0.45) | KDM4EHPGDALDH1A1GAAGFER |
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 4 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 | claimed |
| US-8207347-B2 | Pyridone derivatives as NK3 antagonists | H. LUNDBECK A/S (DK) | 2012-06-26 | — | — | US | claimed |
| EP-2513061-A1 | PYRIDONE DERIVATIVES AS NK3 ANTAGONISTS | H. Lundbeck A/S (DK) | 2012-10-24 | — | — | EP | disclosed |
| US-8207347-B2 | Pyridone derivatives as NK3 antagonists | H. LUNDBECK A/S (DK) | 2012-06-26 | — | — | US | disclosed |