Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 2/20 | 0.51 |
| ▸ | PNMT | P11086 | 3/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | PRCP | P42785 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31233660 | 0.78 | PNMT (0.56) | CD44PNMTMAOB | |
| SCHEMBL2358135 | 0.78 | PNMT (0.56) | CD44PNMTMAOB | |
| SCHEMBL13973793 | 0.78 | CD44 (0.45) | CD44PNMTMAOBPRMT5PRCP | |
| Hydrochloric Acid SCHEMBL33527957 | 0.77 | PNMT (0.55) | CD44PNMTMAOB | |
| Hydrochloric Acid SCHEMBL1124611 | 0.77 | PNMT (0.55) | CD44PNMTMAOB | |
| SCHEMBL2399109 | 0.76 | RXRA (0.46) | — | |
| SCHEMBL8319663 | 0.75 | CD44 (0.53) | CD44PNMTMAOBPRCPP2RY1 | |
| SCHEMBL2253086 | 0.75 | CD44 (0.49) | CD44PNMTMAOBPRMT5P2RY1 | |
| SCHEMBL17585072 | 0.75 | CD44 (0.49) | CD44PNMTMAOBHRH3 | |
| SCHEMBL2553918 | 0.75 | CD44 (0.56) | CD44PNMTMAOBPRCP |
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-2018093695-A1 | FACTOR XIIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-05-24 | — | — | WO | disclosed |