Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PROKR1 | Q8TCW9 | 14/20 | 0.35 |
| ▸ | BTK | Q06187 | 4/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16135269 | 0.89 | PROKR1 (0.41) | PROKR1 | |
| SCHEMBL16135262 | 0.85 | BTK (0.39) | BTK | |
| SCHEMBL16135264 | 0.85 | CYP3A4 (0.39) | PROKR1 | |
| SCHEMBL16135261 | 0.82 | CYP3A4 (0.40) | — | |
| SCHEMBL16135243 | 0.80 | CYP3A4 (0.40) | — | |
| SCHEMBL13116885 | 0.77 | MAPT (0.38) | BTK | |
| SCHEMBL16135265 | 0.74 | GABRA1 (0.41) | — | |
| SCHEMBL13116854 | 0.72 | CYP3A4 (0.40) | — | |
| SCHEMBL13117259 | 0.72 | CYP3A4 (0.39) | — | |
| SCHEMBL15273565 | 0.72 | CYP3A4 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2978763-B1 | 2-KETO AMIDE DERIVATIVES AS HIV ATTACHMENT INHIBITORS | VIIV HEALTHCARE UK (NO 5) LTD (GB) | 2018-03-07 | — | — | EP | disclosed |