Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | ALPI | P09923 | 1/20 | 0.38 |
| ▸ | ALPG | P10696 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 3/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4133551 | 0.99 | NPC1 (0.37) | NPC1ALPLALPIALPGKMT2A | |
| SCHEMBL5253831 | 0.81 | CHRM2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL5186342 | 0.80 | — | — | |
| SCHEMBL4696280 | 0.79 | NPC1 (0.41) | NPC1ALPLALPIALPGKMT2A | |
| SCHEMBL4130645 | 0.74 | APOBEC3G (0.33) | — | |
| SCHEMBL4133554 | 0.70 | RAB9A (0.35) | KMT2AMEN1RAB9A | |
| SCHEMBL5185306 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL5186492 | 0.65 | — | — | |
| SCHEMBL5272076 | 0.64 | CA1 (0.31) | — | |
| SCHEMBL5255401 | 0.63 | — | — |
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-1569935-B1 | HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREOF AND USE OF SAME AS MEDICAMENTS, SUCH AS ANTI-BACTERIAL MEDICAMENTS AND BETA-LACTAMASE INHIBITORS | NOVEXEL (FR) | 2008-08-20 | — | — | EP | disclosed |