Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.57 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 12/20 | 0.55 |
| ▸ | DRD2 | P14416 | 9/20 | 0.52 |
| ▸ | HTR2A | P28223 | 4/20 | 0.52 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.50 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5842816 | 0.99 | GRIN1 (0.56) | GRIN1GRIN2BCHRM1DRD2HTR2A | |
| SCHEMBL6980280 | 0.80 | HTR1A (0.49) | GRIN1GRIN2BKCNH2HTR1A | |
| Hydrochloric Acid SCHEMBL5841481 | 0.79 | HTR1A (0.48) | GRIN1GRIN2BKCNH2HTR1A | |
| SCHEMBL8013233 | 0.78 | CHRM1 (0.61) | CHRM1DRD2HTR2AMCHR1KCNH2 | |
| SCHEMBL3291823 | 0.76 | GRIN1 (0.64) | GRIN1GRIN2BCHRM1DRD2HTR1A | |
| SCHEMBL3290503 | 0.75 | GRIN1 (0.60) | GRIN1GRIN2BCHRM1DRD2HTR1A | |
| SCHEMBL4233191 | 0.74 | CHRM1 (0.68) | CHRM1DRD2HTR2AMCHR1KCNH2 | |
| SCHEMBL5841552 | 0.73 | GRIN1 (0.55) | GRIN1GRIN2BDRD2ALDH1A1 | |
| SCHEMBL31033170 | 0.73 | DRD4 (0.67) | CHRM1DRD2HTR2AMCHR1KCNH2 | |
| SCHEMBL1764705 | 0.73 | ALDH1A1 (0.55) | CHRM1DRD2HTR2AMCHR1HTR1A |
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-1275647-B1 | Octahydro-2H-pyrido[1,2-a]pyrazine derivatives, process for their preparation and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2003-11-12 | — | — | EP | disclosed |
| EP-1275647-A1 | Octahydro-2H-pyrido[1,2-a]pyrazine derivatives, process for their preparation and pharmaceutical compositions containing them | Les Laboratoires Servier (FR) | 2003-01-15 | — | — | EP | disclosed |