Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 5/20 | 0.51 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | SRC | P12931 | 2/20 | 0.44 |
| ▸ | USP7 | Q93009 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 3/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.44 |
| ▸ | AXL | P30530 | 1/20 | 0.44 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.44 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23638931 | 0.83 | TRPA1 (0.60) | TRPA1FAAHSRCUSP7AR | |
| SCHEMBL13680579 | 0.83 | NR3C1 (0.60) | TRPA1FAAHARAPPNR3C1 | |
| SCHEMBL378619 | 0.81 | CHEK1 (0.57) | TRPA1SRCUSP7ARAPP | |
| SCHEMBL30006507 | 0.81 | CHEK1 (0.57) | TRPA1SRCUSP7ARAPP | |
| SCHEMBL20004068 | 0.81 | TRPA1 (0.55) | TRPA1FAAHARAPPNR3C1 | |
| SCHEMBL5343977 | 0.80 | CHEK1 (0.56) | TRPA1SRCUSP7ARAPP | |
| SCHEMBL17547028 | 0.79 | TRPA1 (0.49) | TRPA1FAAHUSP7ARAPP | |
| SCHEMBL15340863 | 0.79 | TRPA1 (0.49) | IRAK4TRPA1FAAHARAPP | |
| SCHEMBL21464284 | 0.78 | TRPA1 (0.58) | TRPA1FAAHSRCUSP7AR | |
| SCHEMBL31729795 | 0.77 | TRPA1 (0.54) | TRPA1FAAHSRCUSP7AR |
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-3144311-A1 | TRICYCLIC HETEROCYCLIC DERIVATIVE HAVING HIV REPLICATION-INHIBITING EFFECT | Shionogi & Co., Ltd. (JP) | 2017-03-22 | — | — | EP | disclosed |