Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.54 |
| ▸ | CA2 | P00918 | 3/20 | 0.54 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | MMP3 | P08254 | 1/20 | 0.48 |
| ▸ | MMP9 | P14780 | 1/20 | 0.48 |
| ▸ | NPY1R | P25929 | 12/20 | 0.47 |
| ▸ | NPFFR1 | Q9GZQ6 | 2/20 | 0.46 |
| ▸ | NPFFR2 | Q9Y5X5 | 2/20 | 0.46 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.45 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.45 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | NPY4R | P50391 | 2/20 | 0.44 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8119336 | 0.92 | CA1 (0.55) | CA1CA2MMP1MMP3MMP9 | |
| SCHEMBL8120861 | 0.87 | NPY1R (0.61) | CA1CA2NPY1RNPFFR1NPFFR2 | |
| SCHEMBL8123225 | 0.84 | CA1 (0.57) | CA1CA2NPY1RNPFFR1NPFFR2 | |
| SCHEMBL8119632 | 0.84 | NPY1R (0.55) | NPY1RNPFFR1NPFFR2NPY5RNPY4R | |
| SCHEMBL8114737 | 0.82 | NPY1R (0.49) | CA1CA2MMP1MMP3MMP9 | |
| SCHEMBL8121858 | 0.82 | NPY1R (0.55) | NPY1RNPFFR1NPFFR2NPY5RNPY4R | |
| SCHEMBL8121075 | 0.82 | NPSR1 (0.52) | CA1CA2MMP1MMP3MMP9 | |
| SCHEMBL8121078 | 0.82 | NPSR1 (0.52) | CA1CA2MMP1MMP3MMP9 | |
| SCHEMBL8120100 | 0.79 | NPY1R (0.50) | CA1CA2MMP1MMP3MMP9 | |
| SCHEMBL8112883 | 0.79 | MEN1 (0.54) | CA1CA2MMP1MMP3MMP9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0680469-B1 | AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME | BOEHRINGER INGELHEIM PHARMA (DE) | 2000-04-26 | — | — | EP | disclosed |