Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 7/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 2/20 | 0.30 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.30 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.30 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.30 |
| ▸ | ST14 | Q9Y5Y6 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16623558 | 0.82 | PARP1 (0.34) | PARP1 | |
| SCHEMBL17849239 | 0.82 | HDAC1 (0.46) | EGFRPARP1 | |
| SCHEMBL16623511 | 0.81 | TYK2 (0.38) | PARP1 | |
| SCHEMBL17849218 | 0.80 | HDAC6 (0.40) | HDAC6PARP1 | |
| SCHEMBL16726648 | 0.79 | KDR (0.33) | PARP1 | |
| SCHEMBL16726656 | 0.79 | PTGS2 (0.33) | PRSS1PARP1 | |
| SCHEMBL16623601 | 0.77 | PRSS1 (0.37) | EGFRPRSS1PRSS2PRSS3 | |
| SCHEMBL16623503 | 0.76 | EGFR (0.35) | EGFRPARP1 | |
| SCHEMBL17849238 | 0.76 | L3MBTL1 (0.38) | HDAC6EGFRPARP1 | |
| SCHEMBL18052621 | 0.76 | BRD4 (0.34) | EGFRPARP1 |
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-2857400-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2015-04-08 | — | — | EP | disclosed |