Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 18/20 | 0.62 |
| ▸ | PKD1 | P98161 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.35 |
| ▸ | FPR2 | P25090 | 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 | |
|---|---|---|---|---|
| SCHEMBL16517369 | 0.93 | MAP3K14 (0.53) | MAP3K14PKD1 | |
| SCHEMBL16517334 | 0.90 | MAP3K14 (0.51) | MAP3K14PKD1 | |
| SCHEMBL16517538 | 0.89 | MAP3K14 (0.47) | MAP3K14PKD1 | |
| SCHEMBL16517790 | 0.88 | MAP3K14 (0.46) | MAP3K14PKD1SCN9A | |
| SCHEMBL16517188 | 0.86 | MAP3K14 (0.46) | MAP3K14PKD1 | |
| SCHEMBL21859091 | 0.84 | MAP3K14 (0.62) | MAP3K14PKD1SCN9A | |
| SCHEMBL16517822 | 0.84 | MAP3K14 (0.62) | MAP3K14PKD1SCN9A | |
| SCHEMBL16517169 | 0.83 | MAP3K14 (0.55) | MAP3K14PKD1SCN9A | |
| SCHEMBL16517378 | 0.83 | MAP3K14 (0.43) | MAP3K14PKD1 | |
| SCHEMBL16516863 | 0.83 | MAP3K14 (0.46) | MAP3K14PKD1SCN9A |
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-3036229-A1 | ALKYNYL ALCOHOLS AND METHODS OF USE | F. Hoffmann-La Roche AG (CH) | 2016-06-29 | — | — | EP | disclosed |
| WO-2015025026-A1 | ALKYNYL ALCOHOLS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2015-02-26 | — | — | WO | disclosed |