Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 18/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 15/20 | 0.45 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5645650 | 0.88 | PTGS2 (0.47) | PTGS2PTGS1 | |
| SCHEMBL5647775 | 0.87 | PTGS2 (0.46) | PTGS2PTGS1 | |
| SCHEMBL27918786 | 0.86 | PTGS2 (0.45) | PTGS2PTGS1 | |
| SCHEMBL27901009 | 0.83 | PTGS2 (0.60) | PTGS2PTGS1 | |
| SCHEMBL5646653 | 0.82 | PTGS2 (0.52) | PTGS2PTGS1P2RY6 | |
| SCHEMBL5644434 | 0.81 | PTGS2 (0.51) | PTGS2PTGS1 | |
| SCHEMBL5668215 | 0.81 | PTGS2 (0.41) | PTGS2PTGS1 | |
| SCHEMBL14440933 | 0.80 | PTGS2 (0.48) | PTGS2PTGS1 | |
| SCHEMBL5648714 | 0.79 | PTGS2 (0.72) | PTGS2PTGS1 | |
| SCHEMBL5646929 | 0.79 | PTGS2 (0.51) | PTGS2PTGS1P2RY6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103044477-B | Trimethyl silicane replaces benzopyrans compounds and application thereof | GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) | 2015-08-05 | — | — | CN | disclosed |
| CN-103044477-A | Trimethyl silicon substituted benzopyran compound and application thereof | GUANGZHOU INST BIOMED & HEALTH | 2013-04-17 | — | — | CN | disclosed |