Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.30 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20813944 | 0.92 | — | — | |
| SCHEMBL20803199 | 0.90 | HSD17B1 (0.33) | GRM5HSD17B1HSD17B2 | |
| SCHEMBL20813653 | 0.90 | CYP11B1 (0.33) | HSD17B1HSD17B2 | |
| SCHEMBL20813282 | 0.90 | HSD17B1 (0.33) | HSD17B1HSD17B2 | |
| SCHEMBL20813499 | 0.89 | CA12 (0.31) | GRM5 | |
| SCHEMBL20813975 | 0.86 | — | — | |
| SCHEMBL20803158 | 0.85 | HSD17B1 (0.30) | HSD17B1HSD17B2 | |
| SCHEMBL20813674 | 0.84 | CYP11B1 (0.31) | — | |
| SCHEMBL20802466 | 0.83 | GRM5 (0.35) | GRM5 | |
| SCHEMBL20813648 | 0.83 | PDE9A (0.32) | — |
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-3453697-A1 | COMPOUND HAVING NAPHTHALENE RING, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | JNC Corporation (JP) | 2019-03-13 | — | — | EP | disclosed |