Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 1/20 | 0.56 |
| ▸ | ITGB3 | P05106 | 6/20 | 0.52 |
| ▸ | ITGA2B | P08514 | 6/20 | 0.52 |
| ▸ | TACR1 | P25103 | 2/20 | 0.51 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.50 |
| ▸ | CTSL | P07711 | 2/20 | 0.50 |
| ▸ | CTSB | P07858 | 2/20 | 0.50 |
| ▸ | CTSS | P25774 | 2/20 | 0.50 |
| ▸ | CTSK | P43235 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9256981 | 1.00 | TYR (0.56) | TYRITGB3ITGA2BTACR1CTRB1 | |
| SCHEMBL3573493 | 0.84 | CTSS (0.52) | TYRITGB3CTSSCTSKALDH1A1 | |
| SCHEMBL219151 | 0.83 | TACR1 (0.68) | TYRITGB3ITGA2BTACR1CTRB1 | |
| SCHEMBL479010 | 0.83 | TACR1 (0.68) | TYRITGB3ITGA2BTACR1CTRB1 | |
| SCHEMBL7372270 | 0.83 | TACR1 (0.68) | TYRITGB3ITGA2BTACR1CTRB1 | |
| SCHEMBL220648 | 0.83 | TACR1 (0.68) | TYRITGB3ITGA2BTACR1CTRB1 | |
| SCHEMBL26661077 | 0.83 | TACR1 (0.68) | TYRITGB3ITGA2BTACR1CTRB1 | |
| SCHEMBL16847808 | 0.82 | TYR (0.45) | TYRTACR1CTRB1CTSLCTSB | |
| SCHEMBL16847804 | 0.82 | CTSL (0.53) | ITGB3CTSL | |
| Hypochlorous Acid SCHEMBL7368156 | 0.81 | TACR1 (0.65) | TYRITGB3ITGA2BTACR1CTRB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0509354-B1 | Amino acid derivatives | HOFFMANN LA ROCHE (CH) | 2000-08-23 | — | — | EP | disclosed |
| US-5393875-A | Hypotensive, cardiotonic and antiischemic agents | HOFFMANN-LA ROCHE INC. (US) | 1995-02-28 | — | — | US | disclosed |