Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 9/20 | 0.49 |
| ▸ | PRKD1 | Q15139 | 2/20 | 0.49 |
| ▸ | PAK4 | O96013 | 2/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.37 |
| ▸ | TTBK1 | Q5TCY1 | 4/20 | 0.33 |
| ▸ | CDC7 | O00311 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 2/20 | 0.33 |
| ▸ | TTBK2 | Q6IQ55 | 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 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL12001476 | 0.79 | MAP3K14 (0.55) | MAP3K14PRKD1PAK4ROCK1TTBK1 | |
| SCHEMBL11970324 | 0.78 | MAP3K14 (0.60) | MAP3K14PRKD1PAK4CDC7CDK2 | |
| SCHEMBL11970842 | 0.77 | MAP3K14 (0.73) | MAP3K14PRKD1PAK4TTBK1TTBK2 | |
| SCHEMBL12001441 | 0.75 | MAP3K14 (0.59) | MAP3K14PRKD1PAK4ROCK1TTBK1 | |
| SCHEMBL12490348 | 0.74 | ROCK1 (0.34) | MAP3K14PAK4ROCK1TTBK1CDC7 | |
| SCHEMBL11971276 | 0.74 | MAP3K14 (0.53) | MAP3K14PRKD1PAK4ROCK1CDC7 | |
| SCHEMBL11970865 | 0.74 | MAP3K14 (0.53) | MAP3K14PRKD1PAK4ROCK1CDC7 | |
| SCHEMBL12489661 | 0.74 | MAP3K14 (0.51) | MAP3K14PRKD1PAK4ROCK1CDC7 | |
| SCHEMBL11970735 | 0.73 | MAP3K14 (0.74) | MAP3K14PRKD1PAK4TTBK1TTBK2 | |
| SCHEMBL11970535 | 0.71 | MAP3K14 (0.64) | MAP3K14PRKD1PAK4CDC7CDK2 |
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-2686314-A1 | 6,5-HETEROCYCLIC PROPARGYLIC ALCOHOL COMPOUNDS AND USES THEREFOR | F.HOFFMANN-LA ROCHE AG (CH) | 2014-01-22 | — | — | EP | disclosed |
| WO-2012123522-A1 | 6,5-HETEROCYCLIC PROPARGYLIC ALCOHOL COMPOUNDS AND USES THEREFOR | F. HOFFMANN-LA ROCHE AG (CH) | 2012-09-20 | — | — | WO | disclosed |