Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 8/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL20285948 | 0.77 | TRPA1 (0.52) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL7537241 | 0.77 | LMNA (0.39) | GABRA1GABRB2TRPA1LMNACHRM1 | |
| SCHEMBL20346962 | 0.75 | HRH4 (0.37) | APPTRPA1LMNACHRM1SLC6A2 | |
| SCHEMBL21725473 | 0.75 | KMT2A (0.47) | GABRA1GABRB1TRPA1LMNACHRM1 | |
| SCHEMBL12197671 | 0.75 | GABRA1 (0.52) | GABRA1GABRB1GABRB2TRPA1LMNA | |
| SCHEMBL16860570 | 0.73 | GABRA1 (0.44) | GABRA1GABRB1GABRB2TRPA1LMNA | |
| SCHEMBL21756923 | 0.72 | SLC6A4 (0.46) | GABRA1GABRB1GABRB2SLC6A2ALDH1A1 | |
| SCHEMBL20368242 | 0.72 | TRPA1 (0.31) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL20368413 | 0.72 | CYP1A2 (0.39) | TRPA1LMNAALDH1A1 | |
| SCHEMBL21756944 | 0.71 | APP (0.39) | APPLMNASLC6A2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020039092-A2 | NOVEL AROMATIC MOLECULES | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |
| WO-2020039094-A1 | PHENOXY(HETERO)ARYL ETHERS OF ANTIPROLIFERATIVE ACTIVITY | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |
| WO-2020039088-A2 | NOVEL COMPOUNDS | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |