Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 8/20 | 0.36 |
| ▸ | HTR2C | P28335 | 8/20 | 0.36 |
| ▸ | HTR2B | P41595 | 8/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4478989 | 1.00 | TRPA1 (0.42) | TRPA1HTR2AHTR2CHTR2BTRPM8 | |
| SCHEMBL4482328 | 1.00 | TRPA1 (0.42) | TRPA1HTR2AHTR2CHTR2BTRPM8 | |
| SCHEMBL13627313 | 0.86 | TRPA1 (0.36) | TRPA1HTR2AHTR2CHTR2BTRPM8 | |
| SCHEMBL4477342 | 0.86 | TRPA1 (0.36) | TRPA1HTR2AHTR2CHTR2BTRPM8 | |
| SCHEMBL4472523 | 0.86 | TRPA1 (0.36) | TRPA1HTR2AHTR2CHTR2BTRPM8 | |
| SCHEMBL4483043 | 0.80 | HTR2C (0.33) | HTR2AHTR2CHTR2B | |
| SCHEMBL13627326 | 0.80 | HTR2C (0.33) | HTR2AHTR2CHTR2B | |
| SCHEMBL13627348 | 0.80 | TRPA1 (0.41) | TRPA1HTR2AHTR2CHTR2BTRPM8 | |
| SCHEMBL4477738 | 0.80 | TRPA1 (0.41) | TRPA1HTR2AHTR2CHTR2BTRPM8 | |
| SCHEMBL13627329 | 0.74 | HTR2C (0.42) | HTR2C |
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-7618980-B2 | Pyrrolo(oxo)quinolines as 5HT ligands | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-11-17 | — | — | US | disclosed |