Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL16280971 | 0.87 | CYP3A4 (0.31) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL15292000 | 0.87 | SLC15A1 (0.40) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL19173325 | 0.85 | CYP3A4 (0.32) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL15214443 | 0.85 | CYP3A4 (0.32) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL16256661 | 0.85 | CYP3A4 (0.32) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL18819939 | 0.84 | CYP3A4 (0.31) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL15781128 | 0.84 | CYP3A4 (0.31) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL13901974 | 0.84 | CYP3A4 (0.31) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL16372520 | 0.84 | CYP3A4 (0.31) | CYP3A4SLC7A5CYP1A2 | |
| SCHEMBL14319829 | 0.84 | CYP3A4 (0.31) | CYP3A4SLC7A5CYP1A2 |
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-8557776-B2 | Compounds and methods for 18F labeled agents | Bayer Pharma AG (DE) | 2013-10-15 | — | — | US | disclosed |