Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 4/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.33 |
| ▸ | PAK4 | O96013 | 2/20 | 0.33 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.33 |
| ▸ | PAK2 | Q13177 | 1/20 | 0.33 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.33 |
| ▸ | PAK6 | Q9NQU5 | 1/20 | 0.33 |
| ▸ | PAK5 | Q9P286 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
| ▸ | HPSE | Q9Y251 | 2/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
| ▸ | FASN | P49327 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.30 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.30 |
| ▸ | HPGDS | O60760 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16517805 | 0.93 | MAP3K14 (0.39) | MAP3K14PAK4PAK1PAK2PKN1 | |
| SCHEMBL16517572 | 0.86 | MAP3K14 (0.33) | MAP3K14HCAR3PAK4PAK1PAK2 | |
| SCHEMBL16516820 | 0.81 | MAP3K14 (0.38) | MAP3K14PAK4PAK1PAK2PKN1 | |
| SCHEMBL16517729 | 0.81 | MAP3K14 (0.38) | MAP3K14PAK4PAK1PAK2PKN1 | |
| SCHEMBL16517394 | 0.81 | MAP3K14 (0.51) | MAP3K14 | |
| SCHEMBL16517592 | 0.80 | MAP3K14 (0.39) | MAP3K14PAK4PAK1PAK2PKN1 | |
| SCHEMBL16517273 | 0.80 | MAP3K14 (0.38) | MAP3K14PAK4PAK1PAK2PKN1 | |
| SCHEMBL16517003 | 0.79 | HCAR3 (0.31) | MAP3K14HCAR3 | |
| SCHEMBL16505384 | 0.75 | MAP3K14 (0.58) | MAP3K14 | |
| SCHEMBL16505892 | 0.75 | MAP3K14 (0.58) | MAP3K14 |
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 |