Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3271304 | 0.72 | CYP3A4 (0.37) | — | |
| SCHEMBL7790061 | 0.72 | SIGMAR1 (0.35) | — | |
| SCHEMBL9610424 | 0.71 | NPSR1 (0.33) | ALDH1A1ACHE | |
| SCHEMBL7782467 | 0.70 | SIGMAR1 (0.37) | ALDH1A1 | |
| SCHEMBL7790327 | 0.70 | SIGMAR1 (0.37) | ALDH1A1 | |
| SCHEMBL7788013 | 0.70 | SIGMAR1 (0.37) | ALDH1A1 | |
| SCHEMBL7790087 | 0.67 | SIGMAR1 (0.35) | — | |
| SCHEMBL7258924 | 0.67 | — | — | |
| SCHEMBL28195589 | 0.64 | SIGMAR1 (0.39) | — | |
| SCHEMBL8669559 | 0.63 | CYSLTR2 (0.41) | CYSLTR2CYSLTR1 |
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-0084822-A2 | Diphosphonic acid derivatives and pharmaceutical preparations containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1983-08-03 | — | — | EP | disclosed |