Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 8/20 | 0.71 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.68 |
| ▸ | HTR6 | P50406 | 5/20 | 0.65 |
| ▸ | CDK4 | P11802 | 2/20 | 0.50 |
| ▸ | CCND1 | P24385 | 2/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.46 |
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 SCHEMBL5842626 | 0.99 | HTR7 (0.70) | HTR7ABCB1HTR6CDK4CCND1 | |
| SCHEMBL5842531 | 0.93 | ABCB1 (0.80) | HTR7ABCB1HTR6CDK4CCND1 | |
| SCHEMBL6984967 | 0.93 | ABCB1 (0.76) | HTR7ABCB1HTR6CDK4CCND1 | |
| Hydrochloric Acid SCHEMBL5840985 | 0.92 | ABCB1 (0.78) | HTR7ABCB1HTR6CDK4CCND1 | |
| Hydrochloric Acid SCHEMBL5840496 | 0.92 | ABCB1 (0.74) | HTR7ABCB1HTR6CDK4CCND1 | |
| SCHEMBL12124562 | 0.81 | ABCB1 (1.00) | HTR7ABCB1CDK4CCND1SIGMAR1 | |
| SCHEMBL3990185 | 0.78 | CDK4 (0.71) | HTR7ABCB1HTR6CDK4CCND1 | |
| SCHEMBL29780338 | 0.78 | CDK4 (0.71) | HTR7ABCB1HTR6CDK4CCND1 | |
| SCHEMBL6978580 | 0.77 | HTR7 (0.88) | HTR7ABCB1HTR6SIGMAR1 | |
| SCHEMBL12543448 | 0.76 | CDK4 (0.69) | HTR7ABCB1HTR6CDK4CCND1 |
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 |