Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 15/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18537881 | 0.73 | NR1H2 (0.53) | NR1H2NR1H3 | |
| SCHEMBL5957852 | 0.71 | NR1H2 (0.51) | NR1H2NR1H3 | |
| SCHEMBL7902953 | 0.70 | NR1H2 (0.55) | NR1H2NR1H3 | |
| SCHEMBL29781083 | 0.70 | NR1H2 (0.55) | NR1H2NR1H3 | |
| SCHEMBL29524946 | 0.70 | NR1H2 (0.55) | NR1H2NR1H3 | |
| SCHEMBL29725642 | 0.69 | NR1H2 (0.54) | NR1H2NR1H3 | |
| SCHEMBL4251782 | 0.69 | NR1H2 (0.54) | NR1H2NR1H3 | |
| SCHEMBL3852059 | 0.69 | NR1H2 (0.57) | NR1H2NR1H3 | |
| SCHEMBL27819044 | 0.69 | TUBB1 (0.49) | — | |
| SCHEMBL28370896 | 0.68 | NR1H2 (0.55) | NR1H2NR1H3 |
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-6228868-B1 | ANTICARCINOGENIC AND ANTITUMOR AGENTS | ABBOTT LABORATORIES | 2001-05-08 | — | — | US | disclosed |