Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 16/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7136299 | 0.90 | HTR6 (0.77) | HTR6NPSR1POLBHTR2BMAPT | |
| SCHEMBL7136292 | 0.87 | HTR6 (0.81) | HTR6NPSR1POLBHTR2BMAPT | |
| SCHEMBL7134659 | 0.85 | HTR6 (0.78) | HTR6NPSR1POLBHTR2BKCNH2 | |
| SCHEMBL7137689 | 0.84 | HTR6 (0.57) | HTR6NPSR1POLBHTR2BMAPT | |
| SCHEMBL7137685 | 0.84 | HTR6 (0.57) | HTR6NPSR1POLBHTR2BMAPT | |
| SCHEMBL7134667 | 0.82 | HTR6 (0.55) | HTR6HTR2BKCNH2 | |
| SCHEMBL7140819 | 0.82 | HTR6 (0.55) | HTR6HTR2BKCNH2 | |
| SCHEMBL7136346 | 0.77 | HTR6 (1.00) | HTR6HTR2BMAPTKDM4EKCNH2 | |
| SCHEMBL7142930 | 0.77 | HTR6 (0.58) | HTR6NPSR1HTR2BMAPTKDM4E | |
| SCHEMBL7139029 | 0.77 | HTR6 (0.58) | HTR6NPSR1HTR2BMAPTKDM4E |
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-0941994-B1 | Pyrazolopyrimidines and pyrazolotriazines with 5-HT6 receptor affinity | HOFFMANN LA ROCHE (CH) | 2003-05-14 | — | — | EP | disclosed |
| US-6194410-B1 | ANTISEROTONINE AGENTS; NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS | HOFFMAN-LA ROCHE INC. | 2001-02-27 | — | — | US | disclosed |
| EP-0941994-A1 | Pyrazolopyrimidines and pyrazolotriazines with 5-HT6 receptor affinity | F. HOFFMANN-LA ROCHE AG (CH) | 1999-09-15 | — | — | EP | disclosed |