Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL15235717 | 0.89 | PRSS1 (0.35) | HSP90AA1NTSR1 | |
| SCHEMBL15235716 | 0.89 | — | — | |
| SCHEMBL15227735 | 0.89 | — | — | |
| SCHEMBL15238004 | 0.83 | — | — | |
| SCHEMBL15235715 | 0.83 | PRSS1 (0.35) | HSP90AA1NTSR1 | |
| SCHEMBL19665055 | 0.83 | — | — | |
| SCHEMBL254622 | 0.83 | — | — | |
| SCHEMBL255216 | 0.82 | KDM4E (0.40) | — | |
| SCHEMBL19262603 | 0.82 | — | — | |
| SCHEMBL19684183 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012031298-A2 | ETHYNYLBENZENE DERIVATIVES | DUKE UNIVERSITY (US) | 2012-03-08 | — | — | WO | disclosed |