Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | TYK2 | P29597 | 1/20 | 0.48 |
| ▸ | TACR1 | P25103 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GPBAR1 | Q8TDU6 | 12/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6862976 | 0.88 | TACR1 (0.47) | MAPK1TYK2TACR1L3MBTL1GPBAR1 | |
| SCHEMBL6637548 | 0.83 | SIRT3 (0.50) | TYK2TACR1SIRT3TDP1GPBAR1 | |
| SCHEMBL29971293 | 0.82 | GAA (0.53) | MAPK1L3MBTL1KMT2AALDH1A1LMNA | |
| SCHEMBL30107188 | 0.82 | SIRT3 (0.61) | MAPK1TYK2L3MBTL1SIRT3TDP1 | |
| SCHEMBL13162016 | 0.82 | SIRT3 (0.61) | MAPK1TYK2L3MBTL1SIRT3TDP1 | |
| SCHEMBL6641437 | 0.82 | ALDH1A1 (0.50) | TYK2TACR1L3MBTL1SIRT3TDP1 | |
| SCHEMBL6825048 | 0.81 | SIRT3 (0.67) | TACR1SIRT3TDP1GPBAR1 | |
| SCHEMBL905344 | 0.75 | GPBAR1 (0.50) | TYK2L3MBTL1GPBAR1KMT2A | |
| SCHEMBL28743630 | 0.75 | POLQ (0.46) | TYK2L3MBTL1KMT2AALDH1A1 | |
| SCHEMBL30674829 | 0.75 | KDM4C (0.49) | MAPK1TYK2L3MBTL1SIRT3TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1293056-C | 4-phenyl-pyridine derivatives as neurokinin-1 receptor antagonists | HOFFMANN LA ROCHE (CH) | 2007-01-03 | — | — | CN | disclosed |
| CN-1610670-A | 4-phenyl-pyridine derivatives as neurokinin-1 receptor antagonists | HOFFMANN LA ROCHE (CH) | 2005-04-27 | — | — | CN | disclosed |
| EP-1406618-A2 | USE OF NK-1 RECEPTOR ANTAGONISTS WITH PYRIDINIC STRUCTURE FOR THE TREATMENT OF BRAIN, SPINAL OR NERVE INJURY | F. HOFFMANN-LA ROCHE AG (CH) | 2004-04-14 | — | — | EP | disclosed |
| WO-2003006016-A2 | USE OF NK-1 RECEPTOR ANTAGONISTS WITH PYRIDINIC STRUCTURE, FOR THE TREATMENT OF BRAIN, SPINAL OR NERVE INJURY | F. HOFFMANN-LA ROCHE AG (CH) | 2003-01-23 | — | — | WO | disclosed |