Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 14/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | AR | P10275 | 2/20 | 0.49 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.48 |
| ▸ | HRH2 | P25021 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13651291 | 1.00 | ALDH1A1 (0.51) | ALDH1A1HRH3KCNH2AREGLN2 | |
| SCHEMBL251319 | 0.95 | ALDH1A1 (0.50) | ALDH1A1HRH3KCNH2AREGLN2 | |
| SCHEMBL1238918 | 0.81 | HRH3 (0.46) | ALDH1A1HRH3KCNH2KDM4ETP53 | |
| SCHEMBL6446086 | 0.80 | MAOA (0.49) | AR | |
| SCHEMBL24435216 | 0.79 | AR (0.52) | HRH3KCNH2ARKDM4ETP53 | |
| SCHEMBL18786266 | 0.78 | HRH3 (0.49) | ALDH1A1HRH3ARTP53 | |
| SCHEMBL24824101 | 0.78 | HRH3 (0.49) | ALDH1A1HRH3ARTP53 | |
| SCHEMBL249782 | 0.77 | MTOR (0.52) | HRH3KCNH2 | |
| SCHEMBL24989412 | 0.77 | HRH3 (0.49) | ALDH1A1HRH3KCNH2KDM4ETP53 | |
| SCHEMBL249781 | 0.77 | MTOR (0.52) | HRH3KCNH2 |
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-2017066863-A1 | HETEROCYCLIC COMPOUNDS AS INHIBITORS OF PLATELET AGGREGATION | UNIVERSITE DE MONTREAL (CA) | 2017-04-27 | — | — | WO | disclosed |