Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 11/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 4/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.37 |
| ▸ | PRCP | P42785 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | FFAR2 | O15552 | 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 | |
|---|---|---|---|---|
| SCHEMBL534338 | 0.79 | MEN1 (0.37) | CD274PDCD1PRCPHCRTR1HCRTR2 | |
| SCHEMBL5078499 | 0.73 | HSP90AA1 (0.56) | HSP90AA1HSP90AB1 | |
| SCHEMBL555877 | 0.73 | REN (0.36) | FFAR2 | |
| SCHEMBL7872529 | 0.71 | REN (0.41) | — | |
| SCHEMBL6064290 | 0.71 | TACR1 (0.54) | HSP90AA1HSP90AB1 | |
| SCHEMBL6064294 | 0.71 | TACR1 (0.54) | HSP90AA1HSP90AB1 | |
| SCHEMBL27223574 | 0.71 | BACE1 (0.40) | HSP90AA1HSP90AB1 | |
| SCHEMBL6550098 | 0.70 | TACR1 (0.53) | HSP90AA1HSP90AB1 | |
| SCHEMBL27223527 | 0.70 | EPHX1 (0.39) | HSP90AA1HSP90AB1 | |
| SCHEMBL6310168 | 0.69 | HSP90AA1 (0.61) | HSP90AA1HSP90AB1 |
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-2413941-A1 | RENIN INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2012-02-08 | — | — | EP | disclosed |