Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.30 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6744478 | 0.79 | CA1 (0.34) | RIPK1ALDH1A1HTT | |
| SCHEMBL10158653 | 0.77 | BACE1 (0.36) | RIPK1HTTTAAR1 | |
| SCHEMBL6203927 | 0.77 | HTT (0.47) | RIPK1ALDH1A1HTTDAO | |
| SCHEMBL27569314 | 0.74 | CALM1 (0.48) | — | |
| SCHEMBL14402511 | 0.73 | BACE1 (0.40) | RIPK1HTT | |
| SCHEMBL6890833 | 0.71 | CYP17A1 (0.46) | ALDH1A1TAAR1 | |
| SCHEMBL12533678 | 0.71 | KDM1A (0.38) | ALDH1A1HTTTAAR1 | |
| SCHEMBL13862873 | 0.71 | DAO (0.45) | ALDH1A1DAO | |
| SCHEMBL237271 | 0.69 | — | — | |
| SCHEMBL20099818 | 0.68 | IDO1 (0.31) | — |
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-6677382-B1 | HALOGENATED OXYAMINES, USED AS ENZYME INHIBITORS FOR PROPHYLAXIS OF ATHEROSCLEROSIS AND CARDIOVASCULAR DISORDERS, AND AS ANTILIPEMIC AGENTS | PHARMACIA CORPORATION | 2004-01-13 | — | — | US | disclosed |