Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPA | P38571 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25957888 | 0.88 | LIPA (0.41) | LIPAGAAMGAMSIMGAM2 | |
| SCHEMBL29228545 | 0.86 | LIPA (0.51) | LIPAGAAMGAMSIMGAM2 | |
| SCHEMBL2721040 | 0.84 | — | — | |
| SCHEMBL4269494 | 0.81 | LIPA (0.42) | LIPAGAAMGAMSIMGAM2 | |
| SCHEMBL584738 | 0.79 | LIPA (0.42) | LIPAGAAALDH1A1TDP1POLB | |
| SCHEMBL14473403 | 0.79 | MGAM (0.41) | GAAMGAMSIMGAM2JAK2 | |
| SCHEMBL12590379 | 0.79 | MGAM (0.41) | GAAMGAMSIMGAM2JAK2 | |
| SCHEMBL14389978 | 0.78 | MGAM (0.44) | GAAMGAMSIMGAM2JAK2 | |
| SCHEMBL14389976 | 0.78 | MGAM (0.44) | GAAMGAMSIMGAM2JAK2 | |
| SCHEMBL7790319 | 0.77 | MGAM (0.40) | GAAMGAMSIMGAM2JAK2 |
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-1029845-A1 | 2-(4-Tert-pentylcyclohexyl)acetaldehyde and its use as fragrance compound | QUEST INTERNATIONAL B.V. (NL) | 2000-08-23 | — | — | EP | disclosed |