Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4889381 | 0.83 | TSHR (0.47) | TRPA1TSHRLMNA | |
| SCHEMBL13535399 | 0.82 | TSHR (0.36) | TRPV1TRPA1SPHK1TSHRLMNA | |
| SCHEMBL13356226 | 0.78 | — | — | |
| SCHEMBL21227014 | 0.78 | — | — | |
| SCHEMBL6942924 | 0.78 | — | — | |
| SCHEMBL8533088 | 0.78 | TSHR (0.42) | TSHRLMNA | |
| SCHEMBL107230 | 0.78 | TSHR (0.42) | TSHRLMNA | |
| SCHEMBL731183 | 0.77 | — | — | |
| SCHEMBL22703465 | 0.77 | — | — | |
| SCHEMBL3355860 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012002577-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | 富士フイルム株式会社 (JP) | 2012-01-05 | — | — | WO | disclosed |