Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.55 |
| ▸ | CYP26A1 | O43174 | 5/20 | 0.54 |
| ▸ | CTSS | P25774 | 1/20 | 0.54 |
| ▸ | CTSK | P43235 | 1/20 | 0.54 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.52 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.49 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.48 |
| ▸ | TACR1 | P25103 | 1/20 | 0.48 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.47 |
| ▸ | ITGAV | P06756 | 2/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL204254 | 0.80 | CYP26A1 (0.44) | HRH4CYP26A1CTSSCTSKCYP19A1 | |
| SCHEMBL204255 | 0.80 | CYP26A1 (0.44) | HRH4CYP26A1CTSSCTSKCYP19A1 | |
| SCHEMBL305818 | 0.80 | CASP1 (0.48) | CTSSCTSKTACR1ITGB3ITGAV | |
| SCHEMBL305819 | 0.80 | CASP1 (0.48) | CTSSCTSKTACR1ITGB3ITGAV | |
| SCHEMBL28473741 | 0.79 | SMN1; SMN2 (0.56) | HRH4CTSSCTSKCYP19A1CYP11B1 | |
| SCHEMBL2397464 | 0.79 | PPARA (0.47) | CTSSCTSKTACR1ITGB3ITGAV | |
| SCHEMBL2401482 | 0.79 | PPARA (0.47) | CTSSCTSKCYP19A1TACR1ITGB3 | |
| SCHEMBL22236504 | 0.78 | CYP26A1 (0.57) | HRH4CYP26A1PADI4 | |
| SCHEMBL15132766 | 0.77 | SMN1; SMN2 (0.67) | HRH4 | |
| SCHEMBL9558096 | 0.76 | ITGB3 (0.60) | CTSSCTSKTACR1ITGB3ITGA2B |
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 3 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 |
| EP-0509354-A2 | Amino acid derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1992-10-21 | — | — | EP | disclosed |