Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 6/20 | 0.49 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | KDM4D | Q6B0I6 | 2/20 | 0.42 |
| ▸ | KDM5A | P29375 | 1/20 | 0.41 |
| ▸ | KDM6B | O15054 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KDM4A | O75164 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL4730620 | 0.87 | NUDT1 (0.46) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL17438626 | 0.81 | P2RX1 (0.51) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL30674829 | 0.81 | KDM4C (0.49) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL1232893 | 0.79 | KDM4E (0.64) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL17438629 | 0.79 | P2RX1 (0.50) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL19439267 | 0.79 | KDM4C (0.61) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL1418234 | 0.79 | NUDT1 (0.49) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL16676648 | 0.79 | KDM4C (0.71) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL30843210 | 0.79 | NUDT1 (0.49) | KDM4CMKNK1MKNK2NUDT1KDM4E | |
| SCHEMBL16414446 | 0.78 | KDM4C (0.44) | KDM4CKDM4EALDH1A1GAAGLA |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1157005-B1 | 3-PHENYLPYRIDINE DERIVATIVES AND THEIR USE AS NK-1 RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2004-10-20 | — | — | EP | disclosed |
| CN-1134417-C | 3-phenylpyridine derivatives and their use as NK-1 receptor antagonists | — | 2004-01-14 | — | — | CN | disclosed |
| CN-1341100-A | 3-phenylpyridine derivatives and their use as nk-1 receptor antagonists | HOFFMANN LA ROCHE (CH) | 2002-03-20 | — | — | CN | disclosed |
| EP-1157005-A1 | 3-PHENYLPYRIDINE DERIVATIVES AND THEIR USE AS NK-1 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-11-28 | — | — | EP | disclosed |
| US-6225316-B1 | GOOD AFFINITY TO THE NK-1 RECEPTOR. | HOFFMANN-LA ROCHE INC. | 2001-05-01 | — | — | US | disclosed |
| WO-2000050401-A1 | 3-PHENYLPYRIDINE DERIVATIVES AND THEIR USE AS NK-1 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2000-08-31 | — | — | WO | disclosed |