Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 3/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 2/20 | 0.34 |
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.34 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.34 |
| ▸ | PTGES | O14684 | 1/20 | 0.32 |
| ▸ | OXER1 | Q8TDS5 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4497030 | 0.83 | — | — | |
| SCHEMBL4491376 | 0.81 | GAA (0.33) | — | |
| SCHEMBL4487829 | 0.78 | KDM4E (0.30) | KDM4E | |
| SCHEMBL4480912 | 0.75 | — | — | |
| SCHEMBL4486933 | 0.75 | PLA2G1B (0.43) | PLA2G1B | |
| SCHEMBL4493426 | 0.72 | — | — | |
| SCHEMBL4491009 | 0.71 | ALDH1A1 (0.43) | AGTR1KDM4ECYP1A2HTTSMN1; SMN2 | |
| SCHEMBL4497394 | 0.69 | — | — | |
| SCHEMBL4480830 | 0.69 | ALDH1A1 (0.32) | — | |
| SCHEMBL4497335 | 0.68 | — | — |
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-7504429-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2009-03-17 | — | — | US | claimed |