Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | CFTR | P13569 | 8/20 | 0.42 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16532690 | 0.88 | MAP3K14 (0.50) | MAP3K14PKMCFTRKDM4EALDH1A1 | |
| SCHEMBL16517347 | 0.78 | MAP3K14 (0.44) | MAP3K14PKMKDM4EALDH1A1MEN1 | |
| SCHEMBL18673430 | 0.77 | MAP3K14 (0.51) | MAP3K14CFTRKDM4EALDH1A1MEN1 | |
| SCHEMBL16516454 | 0.76 | MAP3K14 (0.87) | MAP3K14 | |
| SCHEMBL16516723 | 0.73 | MAP3K14 (0.43) | MAP3K14PKMKDM4EALDH1A1POLB | |
| SCHEMBL16516816 | 0.72 | MAP3K14 (0.53) | MAP3K14PIM1 | |
| SCHEMBL16517675 | 0.69 | MAP3K14 (0.48) | MAP3K14KDM4EALDH1A1MEN1POLB | |
| SCHEMBL16517249 | 0.69 | MAP3K14 (0.51) | MAP3K14CFTRKMOKDM4EALDH1A1 | |
| SCHEMBL16516700 | 0.69 | STAT1 (0.49) | MAP3K14KDM4EALDH1A1HIF1A | |
| SCHEMBL12701252 | 0.69 | PKM (0.71) | PKMKDM4EALDH1A1MEN1KMT2A |
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-3036230-A1 | ALKYNYL ALCOHOLS AND METHODS OF USE | F. Hoffmann-La Roche AG (CH) | 2016-06-29 | — | — | EP | disclosed |
| WO-2015025025-A1 | ALKYNYL ALCOHOLS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2015-02-26 | — | — | WO | disclosed |