Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 8/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL16648002 | 0.84 | TRPA1 (0.45) | TRPA1KMT2AMEN1NLRP3PTGS2 | |
| SCHEMBL16635554 | 0.81 | KMT2A (0.43) | TRPA1KMT2AMEN1NLRP3PTGS2 | |
| SCHEMBL17979498 | 0.80 | TRPA1 (0.40) | TRPA1 | |
| SCHEMBL19795019 | 0.80 | PTGS2 (0.37) | TRPA1KMT2AMEN1NLRP3PTGS2 | |
| SCHEMBL16635488 | 0.77 | TRPA1 (0.43) | TRPA1KMT2AMEN1POLBALDH1A1 | |
| SCHEMBL17973850 | 0.77 | TRPA1 (0.43) | TRPA1KMT2AALDH1A1 | |
| SCHEMBL28847111 | 0.76 | TRPA1 (0.41) | TRPA1 | |
| SCHEMBL717945 | 0.76 | MEN1 (0.47) | KMT2AMEN1NLRP3PTGS2POLB | |
| SCHEMBL16635561 | 0.76 | TRPA1 (0.43) | TRPA1KMT2AALDH1A1KDM4EPKM | |
| SCHEMBL16647990 | 0.75 | TRPA1 (0.46) | TRPA1 |
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-3487853-B1 | BICYCLIC PROLINE COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2022-06-08 | — | — | EP | disclosed |
| WO-2018015410-A1 | BICYCLIC PROLINE COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2018-01-25 | — | — | WO | disclosed |