Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.47 |
| ▸ | GMNN | O75496 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CETP | P11597 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | UBE2N | P61088 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28021 | 1.00 | LMNA (0.48) | LMNACYP2D6SPHK1GMNNPOLB | |
| SCHEMBL21836273 | 0.98 | LMNA (0.50) | LMNACYP2D6SPHK1GMNNPOLB | |
| Alcohol SCHEMBL28265316 | 0.98 | LMNA (0.47) | LMNACYP2D6SPHK1GMNNPOLB | |
| Water SCHEMBL15517779 | 0.98 | LMNA (0.47) | LMNACYP2D6SPHK1GMNNPOLB | |
| SCHEMBL21836287 | 0.94 | LMNA (0.50) | LMNACYP2D6SPHK1GMNNPOLB | |
| SCHEMBL25423689 | 0.93 | LMNA (0.47) | LMNACYP2D6SPHK1GMNNPOLB | |
| SCHEMBL22401861 | 0.91 | LMNA (0.41) | LMNACYP2D6SPHK1GMNNPOLB | |
| SCHEMBL28161475 | 0.91 | LMNA (0.46) | LMNACYP2D6SPHK1GMNNPOLB | |
| Ether SCHEMBL15517780 | 0.91 | LMNA (0.41) | LMNACYP2D6SPHK1GMNNPOLB | |
| SCHEMBL28765587 | 0.91 | LMNA (0.44) | LMNACYP2D6SPHK1GMNNPOLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3640234-A1 | ETHERS AND ESTERS OF 1-SUBSTITUTED CYCLOALKANOLS FOR USE AS AROMA CHEMICALS | BASF SE (DE) | 2020-04-22 | — | — | EP | disclosed |