Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | CASP4 | P49662 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | CASP9 | P55211 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7324337 | 0.91 | CASP1 (0.46) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL7133634 | 0.88 | MAPT (0.43) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL7134290 | 0.83 | TNF (0.50) | RAB9ALMNAPPARGNR1H2NR1H3 | |
| SCHEMBL7133916 | 0.82 | LMNA (0.43) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL7133922 | 0.82 | LMNA (0.43) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL7133914 | 0.82 | LMNA (0.43) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL7393832 | 0.81 | ALDH1A1 (0.43) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL7137536 | 0.80 | ALOX15 (0.48) | LMNAGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL7335912 | 0.79 | MAPT (0.41) | CASP1CASP3CASP4CASP7CASP9 | |
| SCHEMBL7539270 | 0.78 | MAPT (0.41) | CASP1CASP3CASP4CASP7CASP9 |
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 |
|---|---|---|---|---|---|---|---|
| US-6506744-B1 | Well as pharmaceutically usable salts and esters thereof, inhibit the binding of adhesive proteins to the surface of different types of cell and accordingly influence cell-cell and cell-matrix interactions. Can be used in the form of | HOFFMANN-LA ROCHE INC. | 2003-01-14 | — | — | US | disclosed |
| WO-2001004103-A1 | BENZAZEPINONES AND QUINAZOLINES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-01-18 | — | — | WO | disclosed |