Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.42 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.39 |
| ▸ | HSPB1 | P04792 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27674522 | 0.84 | CA3 (0.41) | CES2CES1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL28365688 | 0.82 | MAPK1 (0.38) | MAPTHTTLMNAMAPK1RAB9A | |
| SCHEMBL27692981 | 0.82 | NPC1 (0.42) | MEN1HPGDKMT2AL3MBTL1LMNA | |
| SCHEMBL5755250 | 0.82 | KDM4E (0.46) | MAPTHPGDKMT2AL3MBTL1CYP2C19 | |
| SCHEMBL5756842 | 0.82 | ALDH1A1 (0.44) | CES2CES1KMT2ACYP3A4HTT | |
| SCHEMBL3739813 | 0.81 | ALDH1A1 (0.44) | CES2CES1MEN1HPGDKMT2A | |
| SCHEMBL823700 | 0.81 | CYP4F2 (0.50) | CES2CES1MAPTMEN1HPGD | |
| SCHEMBL11355453 | 0.81 | ALDH1A1 (0.40) | MAPTMEN1KMT2AHTTMAOB | |
| SCHEMBL6649289 | 0.80 | FFAR1 (0.44) | MAPTHPGDKMT2AHTTLMNA | |
| SCHEMBL28603352 | 0.80 | ALDH1A1 (0.44) | MAPTMEN1HPGDKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1685131-A1 | HYDROXYALKYL SUBSTITUTED PYRIDO-7-PYRIMIDIN-7-ONES | F. Hoffmann-La Roche AG (CH) | 2006-08-02 | — | — | EP | disclosed |
| WO-2005047284-A1 | HYDROXYALKYL SUBSTITUTED PYRIDO-7-PYRIMIDIN-7-ONES | F. HOFFMANN-LA ROCHE AG (CH) | 2005-05-26 | — | — | WO | disclosed |