Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL23320216 | 0.87 | GABRA1 (0.40) | GABRA1GABRB2 | |
| SCHEMBL23320264 | 0.74 | POLB (0.37) | — | |
| SCHEMBL7753295 | 0.61 | CYP2A6 (0.46) | GABRA1GABRB2 | |
| SCHEMBL19625543 | 0.60 | CYP1B1 (0.44) | GABRA1GABRB2 | |
| Ammonia Solution, Strong SCHEMBL27937840 | 0.60 | CYP2A6 (0.45) | GABRA1GABRB2 | |
| SCHEMBL19625541 | 0.59 | POLB (0.41) | GABRA1GABRB2 | |
| SCHEMBL31619719 | 0.59 | CYP1B1 (0.40) | GABRA1GABRB2 | |
| SCHEMBL12855390 | 0.58 | BRD4 (0.33) | — | |
| SCHEMBL12111779 | 0.57 | GABRA1 (0.41) | GABRA1GABRB2 | |
| SCHEMBL2671730 | 0.57 | GABRA1 (0.38) | GABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021083350-A1 | DIIMINE METAL COMPLEX, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 中国石油化工股份有限公司 | 2021-05-06 | — | — | WO | disclosed |