Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | MITF | O75030 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9947645 | 0.83 | CYP1B1 (0.34) | POLBPTGDR2 | |
| SCHEMBL1977058 | 0.76 | ALDH1A1 (0.34) | KDM4ESMN1; SMN2ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL1367105 | 0.73 | CYP1B1 (0.39) | MEN1KMT2AGLP1RPTGDR2 | |
| SCHEMBL9947722 | 0.72 | KDM4E (0.48) | KDM4EALOX15HSD17B10ALDH1A1MAPT | |
| SCHEMBL1976749 | 0.72 | CYP2C9 (0.42) | CYP2C9 | |
| SCHEMBL9947711 | 0.64 | KDM4E (0.54) | KDM4EALOX15HSD17B10ALDH1A1CYP1A2 | |
| SCHEMBL9947969 | 0.63 | KDM4E (0.35) | KDM4EALOX15HSD17B10SMN1; SMN2MITF | |
| SCHEMBL2314611 | 0.62 | CYP1A2 (0.36) | CYP1A2CYP2C9CYP2C19PTGDR2 | |
| SCHEMBL11839787 | 0.59 | KDM4E (0.48) | KDM4EHSD17B10ALDH1A1MAPTLMNA | |
| SCHEMBL23146873 | 0.58 | KDM4E (0.52) | KDM4EHSD17B10SMN1; SMN2MITFHTT |
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 |