Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 7/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 4/20 | 0.45 |
| ▸ | PPARD | Q03181 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.45 |
| ▸ | FABP2 | P12104 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | SLC13A5 | Q86YT5 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22921420 | 0.90 | SLC13A5 (0.50) | PPARAPPARGSMN1; SMN2CYP1A2SLC13A5 | |
| SCHEMBL22728703 | 0.89 | PPARA (0.54) | PPARAFFAR1PPARGPPARDALDH1A1 | |
| SCHEMBL11569485 | 0.85 | ALDH1A1 (0.44) | FFAR1ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL29314248 | 0.85 | SLC13A5 (0.46) | PPARACYP1A2SLC13A5 | |
| SCHEMBL25996884 | 0.83 | SLC13A5 (0.45) | PPARAALDH1A1CYP1A2SLC13A5 | |
| SCHEMBL15496714 | 0.83 | PPARA (0.48) | PPARAFFAR1PPARGPPARDSMN1; SMN2 | |
| SCHEMBL173883 | 0.82 | CYP1A2 (0.51) | PPARAFFAR1ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL30080837 | 0.82 | CYP1A2 (0.51) | PPARAFFAR1ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL9324204 | 0.82 | PRMT1 (0.55) | ALDH1A1MAPTTDP1 | |
| SCHEMBL24440172 | 0.81 | GRM2 (0.50) | FFAR1ALDH1A1SLC13A5KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2604595-B1 | TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOUND THAT CONTAINS SAME AND EXHIBITS ANALGESIC ACTIVITY | SHIONOGI & CO (JP) | 2016-03-16 | — | — | EP | disclosed |
| EP-2604595-A1 | TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOUND THAT CONTAINS SAME AND EXHIBITS ANALGESIC ACTIVITY | Shionogi&Co., Ltd. (JP) | 2013-06-19 | — | — | EP | disclosed |
| WO-2011084846-A1 | QUATERNARY AMMONIUM SALT PRODRUGS | ALKERMES, INC. (US) | 2011-07-14 | — | — | WO | disclosed |