Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.70 |
| ▸ | ADORA2B | P29275 | 7/20 | 0.66 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | PDE4A | P27815 | 1/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.51 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Caffeine SCHEMBL4411922 | 0.85 | ADORA2B (0.59) | LMNAADORA2BGAARXFP1ALDH1A1 | |
| Pimefylline SCHEMBL9252493 | 0.85 | LMNA (0.65) | LMNAADORA2BGAARXFP1ALDH1A1 | |
| Xanthinol SCHEMBL29422811 | 0.83 | LMNA (1.00) | LMNAADORA2BGAARXFP1ALDH1A1 | |
| Xanthinol SCHEMBL121655 | 0.83 | LMNA (1.00) | LMNAADORA2BGAARXFP1ALDH1A1 | |
| SCHEMBL11377360 | 0.83 | LMNA (0.59) | LMNAADORA2BGAARXFP1ALDH1A1 | |
| Etofylline Nicotinate SCHEMBL1649975 | 0.82 | ADORA2B (0.64) | LMNAADORA2BGAARXFP1ALDH1A1 | |
| Etofylline SCHEMBL149271 | 0.81 | ADORA2B (1.00) | LMNAADORA2BRXFP1ALDH1A1MAPK1 | |
| SCHEMBL11389921 | 0.81 | LMNA (0.57) | LMNAADORA2BGAARXFP1ALDH1A1 | |
| SCHEMBL10970102 | 0.79 | LMNA (0.56) | LMNAADORA2BGAARXFP1ALDH1A1 | |
| Theofibrate SCHEMBL28085094 | 0.78 | LMNA (0.51) | LMNAADORA2BGAARXFP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1079650-A | The new purposes of nicotinic acid and derivant thereof | QIU BOLING (CN) | 1993-12-22 | — | — | CN | claimed |