Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 19/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6332768 | 0.83 | HTR6 (0.61) | HTR6 | |
| SCHEMBL6168803 | 0.81 | HTR6 (0.65) | HTR6 | |
| SCHEMBL6331024 | 0.78 | HTR6 (0.52) | HTR6 | |
| SCHEMBL6330560 | 0.72 | HTR6 (0.58) | HTR6 | |
| SCHEMBL3323737 | 0.71 | HTR6 (1.00) | HTR6PTGS1PTGS2 | |
| SCHEMBL6336119 | 0.69 | PNMT (0.60) | HTR6 | |
| SCHEMBL6166337 | 0.66 | HTR2C (0.59) | HTR6 | |
| SCHEMBL6332913 | 0.66 | PNMT (0.53) | HTR6 | |
| SCHEMBL21588295 | 0.66 | HTR6 (1.00) | HTR6 | |
| SCHEMBL21162354 | 0.66 | HTR6 (0.84) | HTR6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6849644-B2 | Isoquinoline derivatives useful in the treatment of CNS disorders | SMITHKLINE BEECHAM P.L.C. (GB) | 2005-02-01 | — | — | US | claimed |