Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTN3A1 | O00481 | 2/20 | 0.48 |
| ▸ | ELANE | P08246 | 2/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.41 |
| ▸ | PRTN3 | P24158 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.38 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 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 | |
|---|---|---|---|---|
| SCHEMBL20833579 | 0.89 | TACR1 (0.40) | BTN3A1MRGPRX4PPARGPPARDPPARA | |
| SCHEMBL18973700 | 0.89 | BTN3A1 (0.48) | BTN3A1ELANEMRGPRX4PRTN3PTGDR2 | |
| SCHEMBL18973556 | 0.89 | MRGPRX4 (0.51) | BTN3A1ELANEMRGPRX4 | |
| SCHEMBL18973559 | 0.87 | BTN3A1 (0.49) | BTN3A1ELANEPRTN3LRRK2 | |
| SCHEMBL22081623 | 0.85 | BTN3A1 (0.46) | BTN3A1MRGPRX4 | |
| SCHEMBL18973565 | 0.85 | BTN3A1 (0.48) | BTN3A1ELANEPRTN3 | |
| SCHEMBL18973698 | 0.85 | BTN3A1 (0.48) | BTN3A1ELANEPRTN3LRRK2 | |
| SCHEMBL18973684 | 0.85 | BTN3A1 (0.52) | BTN3A1ELANEPRTN3 | |
| SCHEMBL18973578 | 0.82 | BTN3A1 (0.46) | BTN3A1ELANEPRTN3 | |
| SCHEMBL18973552 | 0.82 | BTN3A1 (0.52) | BTN3A1ELANEMRGPRX4PRTN3PPARG |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017098252-A1 | DIASTEREOSELECTIVE SYNTHESIS OF PHOSPHATE DERIVATIVES AND OF THE GEMCITABINE PRODRUG NUC-1031 | NUCANA BIOMED LIMITED (GB) | 2017-06-15 | — | — | WO | disclosed |