Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 19/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18781738 | 0.94 | CTSK (0.42) | CTSK | |
| SCHEMBL7884932 | 0.87 | CYP2D6 (0.45) | CTSKCYP2D6 | |
| SCHEMBL7887187 | 0.83 | CTSK (0.41) | CTSKCYP2D6 | |
| SCHEMBL9961170 | 0.80 | CTSK (0.43) | CTSKCYP2D6 | |
| SCHEMBL7959731 | 0.80 | CTSK (0.41) | CTSKCYP2D6 | |
| SCHEMBL15459291 | 0.79 | CTSK (0.45) | CTSKCYP2D6 | |
| SCHEMBL9961219 | 0.78 | CYP2D6 (0.44) | CTSKCYP2D6 | |
| SCHEMBL3498487 | 0.78 | CTSK (0.63) | CTSKCYP2D6 | |
| SCHEMBL13471217 | 0.78 | CTSK (0.63) | CTSKCYP2D6 | |
| SCHEMBL19944668 | 0.78 | CTSK (0.43) | CTSK |
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-9562069-B2 | Selective caspase inhibitors and uses thereof | NEW WORLD LABORATORIES INC. (CA) | 2017-02-07 | — | — | US | disclosed |