Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.54 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.52 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.52 |
| ▸ | BCHE | P06276 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CCR3 | P51677 | 1/20 | 0.49 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2614397 | 1.00 | ACHE (0.54) | ACHEPRMT5WDR77BCHEKDM4E | |
| SCHEMBL20012547 | 0.91 | BCHE (0.62) | ACHEBCHEKDM4EL3MBTL1DRD4 | |
| SCHEMBL27833086 | 0.90 | ACHE (0.62) | ACHEBCHEBACE1DRD2DRD4 | |
| SCHEMBL24652674 | 0.86 | NPC1 (0.58) | ACHEPRMT5WDR77BCHEKDM4E | |
| SCHEMBL4512639 | 0.84 | LTA4H (0.60) | ACHEBCHEBACE1SMN1; SMN2GAA | |
| SCHEMBL3271398 | 0.84 | LTA4H (0.60) | ACHEBCHEBACE1SMN1; SMN2GAA | |
| SCHEMBL2608879 | 0.84 | PRMT5 (0.58) | ACHEPRMT5WDR77BCHEKDM4E | |
| Hydrochloric Acid SCHEMBL18038825 | 0.83 | LTA4H (0.58) | ACHEBCHEBACE1SMN1; SMN2GAA | |
| Acetic Acid SCHEMBL27408239 | 0.82 | BCHE (0.55) | ACHEBCHESMN1; SMN2GAASIGMAR1 | |
| SCHEMBL11534247 | 0.82 | PRMT5 (0.50) | ACHEPRMT5WDR77BCHEKDM4E |
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-0496274-B1 | Tricyclic pyridone derivative | HOFFMANN LA ROCHE (CH) | 1996-07-03 | — | — | EP | disclosed |
| US-5326769-A | Treatment of sleep disorders | HOFFMANN-LA ROCHE INC. (US) | 1994-07-05 | — | — | US | disclosed |
| US-5281711-A | (S)-1-[10-chloro-6,7-dihydro-4-oxo-3-phenyl-4H-benzo[a]quino-lizin-1-yl)carbonyl]-3-ethoxypyrrolidine | HOFFMANN-LA ROCHE INC. (US) | 1994-01-25 | — | — | US | disclosed |
| EP-0496274-A1 | Tricyclic pyridone derivative | F. Hoffmann-La Roche AG (CH) | 1992-07-29 | — | — | EP | disclosed |