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 | |
|---|---|---|---|---|
| SCHEMBL5708163 | 0.79 | — | — | |
| SCHEMBL7956909 | 0.76 | CYP2A6 (0.40) | CYP2A6HTR2A | |
| SCHEMBL6516945 | 0.72 | CYP2A6 (0.36) | CYP2A6HTR2A | |
| SCHEMBL28920988 | 0.66 | CYP2A6 (0.44) | CYP2A6HTR2A | |
| SCHEMBL5865845 | 0.66 | CYP2A6 (0.38) | CYP2A6HTR2A | |
| SCHEMBL249690 | 0.65 | CYP2A6 (0.50) | CYP2A6HTR2A | |
| Ammonia Solution, Strong SCHEMBL29089969 | 0.64 | CYP2A6 (0.42) | CYP2A6HTR2A | |
| Ammonia Solution, Strong SCHEMBL29090004 | 0.64 | CYP2A6 (0.42) | CYP2A6HTR2A | |
| Ammonia Solution, Strong SCHEMBL29089975 | 0.64 | CYP2A6 (0.42) | CYP2A6HTR2A | |
| SCHEMBL1877826 | 0.64 | CYP2A6 (0.42) | CYP2A6HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5348677-A | Electro-optical liquid crystal display element | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1994-09-20 | — | — | US | disclosed |