Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | HSPA5 | P11021 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 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 | |
|---|---|---|---|---|
| SCHEMBL11645314 | 0.85 | PGK1 (0.41) | HMGCRMEN1GAAKMT2ALMNA | |
| SCHEMBL7133257 | 0.84 | HMGCR (0.62) | HMGCRGAALMNARECQLHSPA5 | |
| SCHEMBL7083572 | 0.80 | HMGCR (0.48) | HMGCRGAAALDH1A1NR1I2 | |
| SCHEMBL7133476 | 0.79 | HMGCR (0.50) | HMGCRLMNARECQLNR1I2 | |
| SCHEMBL7084717 | 0.78 | HMGCR (0.48) | HMGCRGAAALDH1A1NR1I2 | |
| SCHEMBL5665091 | 0.77 | GAA (0.33) | MEN1GAAKMT2ALMNARECQL | |
| SCHEMBL5663533 | 0.74 | GAA (0.33) | MEN1GAAKMT2ALMNARECQL | |
| SCHEMBL6370947 | 0.73 | HMGCR (0.66) | HMGCRMEN1GAAKMT2ALMNA | |
| SCHEMBL11648207 | 0.73 | ALDH1A1 (0.51) | MEN1GAAKMT2ALMNAHSPA5 | |
| SCHEMBL7526269 | 0.71 | HMGCR (0.56) | HMGCRMEN1GAAKMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0418064-B1 | Naphthalene and tetrahydronaphthalene gem-diphosphonate derivatives | SYMPHAR SA (CH) | 1994-12-14 | — | — | EP | disclosed |
| EP-0418064-A2 | Naphthalene and tetrahydronaphthalene gem-diphosphonate derivatives | SYMPHAR S.A. (CH) | 1991-03-20 | — | — | EP | disclosed |