Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21058295 | 0.98 | NPSR1 (0.39) | NPSR1MAPTMEN1CYP3A4KMT2A | |
| SCHEMBL22832966 | 0.95 | NPSR1 (0.35) | NPSR1CYP4F2CYP4A11FDPS | |
| SCHEMBL16566623 | 0.91 | NPSR1 (0.33) | NPSR1FDPS | |
| SCHEMBL8910802 | 0.82 | CYP2C19 (0.31) | — | |
| SCHEMBL22833074 | 0.80 | CYP3A4 (0.32) | CYP3A4 | |
| SCHEMBL22832849 | 0.80 | SMN1; SMN2 (0.33) | MEN1KMT2AALDH1A1L3MBTL1 | |
| SCHEMBL22832929 | 0.76 | — | — | |
| SCHEMBL7729907 | 0.73 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL25973904 | 0.73 | NPSR1 (0.48) | NPSR1MAPTMEN1CYP3A4KMT2A | |
| SCHEMBL18158783 | 0.72 | HSD11B1 (0.33) | NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6403818-B1 | ONE POT PROCESS STARTING FROM CARBONYL COMPOUND, ALCOHOL, THIOL OR AMINE, AND PROTECTED HYDROXYDICYANO COMPOUND | EISAI CO., LTD. (JP) | 2002-06-11 | — | — | US | disclosed |