Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8646804 | 0.99 | NPC1 (0.42) | NPC1RAB9ASCN5ASCN2AGAA | |
| SCHEMBL8646015 | 0.93 | MEN1 (0.39) | NPC1RAB9ASCN5ASCN2AMAPT | |
| Hydrochloric Acid SCHEMBL8647775 | 0.92 | MEN1 (0.38) | NPC1RAB9ASCN5ASCN2AMAPT | |
| SCHEMBL8644211 | 0.86 | MAPT (0.36) | NPC1RAB9AGAAMAPTMEN1 | |
| SCHEMBL8644292 | 0.85 | ITGB3 (0.47) | NPC1RAB9ASCN5ASCN2AGAA | |
| Trifluoroacetic Acid SCHEMBL8644126 | 0.84 | MAPT (0.35) | NPC1RAB9ASCN5ASCN2AGAA | |
| Hydrochloric Acid SCHEMBL8646799 | 0.84 | ITGB3 (0.46) | NPC1RAB9ASCN5ASCN2AGAA | |
| SCHEMBL8645977 | 0.83 | POLB (0.37) | NPC1RAB9ASCN5ASCN2AMAPT | |
| Hydrochloric Acid SCHEMBL8644811 | 0.83 | POLB (0.36) | NPC1RAB9ASCN5ASCN2AMAPT | |
| SCHEMBL8643880 | 0.82 | MEN1 (0.34) | NPC1RAB9ASCN5ASCN2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5726185-A | BINDING OF ADHESIVE PROTEINS TO BLOOD PLATELET AGGREGATION AND CELL TO CELL ADHESION | HOFFMANN-LA ROCHE INC. (US) | 1998-03-10 | — | — | US | disclosed |