Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 10/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 10/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | DHODH | Q02127 | 8/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TOP1 | P11387 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15635389 | 0.96 | MEN1 (0.50) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL15636276 | 0.86 | MEN1 (0.72) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL15638283 | 0.85 | MEN1 (0.48) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL15636076 | 0.85 | MEN1 (0.50) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL15639323 | 0.79 | GRM4 (0.49) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL15636196 | 0.79 | GRM4 (0.49) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL15639368 | 0.79 | TOP1 (0.52) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL15635050 | 0.79 | MEN1 (0.61) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL16638716 | 0.78 | MEN1 (0.58) | MEN1KMT2AHTTMAPK1PKM | |
| SCHEMBL17363143 | 0.78 | MEN1 (0.58) | MEN1KMT2AHTTMAPK1PKM |
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-2903965-A1 | N-PROP-2-YNYL CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS | Orion Corporation (FI) | 2015-08-12 | — | — | EP | disclosed |
| WO-2014053694-A1 | N-PROP-2-YNYL CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS | ORION CORPORATION (FI) | 2014-04-10 | — | — | WO | disclosed |