Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | FPR3 | P25089 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8119387 | 0.88 | NPY1R (0.45) | SPHK1NOS1NPY1R | |
| SCHEMBL8114860 | 0.88 | SPHK1 (0.43) | SPHK1NOS1NPY1RCA1CA2 | |
| SCHEMBL8127580 | 0.87 | CYP2C19 (0.43) | SPHK1NOS1NPY1R | |
| SCHEMBL8119096 | 0.85 | SPHK1 (0.41) | SPHK1NOS1NPY1REPHX2NR1H4 | |
| SCHEMBL8119124 | 0.83 | F2 (0.36) | NPY1REPHX2NR1H4CA1CA2 | |
| SCHEMBL8120172 | 0.81 | NPY1R (0.61) | NPY1R | |
| SCHEMBL8114815 | 0.81 | CA2 (0.53) | NPY1RCA1CA2 | |
| SCHEMBL8112352 | 0.79 | NOS1 (0.40) | SPHK1NOS1F2 | |
| SCHEMBL8121201 | 0.78 | NPY1R (0.54) | NPY1RCA1CA2 | |
| SCHEMBL8119527 | 0.77 | POLB (0.45) | NOS1 |
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 |