Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 16/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7966285 | 1.00 | CTSK (0.42) | CTSKCA2CA12CA14CYP2D6 | |
| SCHEMBL7890398 | 0.95 | CYP2D6 (0.45) | CTSKCA2CA12CA14CYP2D6 | |
| SCHEMBL7887187 | 0.85 | CTSK (0.41) | CTSKCA2CA12CA14CYP2D6 | |
| SCHEMBL7888162 | 0.80 | CTSK (0.43) | CTSKCA2CA12CA14CYP2D6 | |
| SCHEMBL7884932 | 0.78 | CYP2D6 (0.45) | CTSKCA2CA12CA14CYP2D6 | |
| SCHEMBL271513 | 0.78 | CTSK (0.60) | CTSKCA2CA12CA14CYP2D6 | |
| SCHEMBL271514 | 0.78 | CTSK (0.60) | CTSKCA2CA12CA14CYP2D6 | |
| SCHEMBL9961219 | 0.75 | CYP2D6 (0.44) | CTSKCYP2D6 | |
| SCHEMBL9961170 | 0.74 | CTSK (0.43) | CTSKCYP2D6 | |
| SCHEMBL7959731 | 0.74 | CTSK (0.41) | CTSKCA2CYP2D6CA1CA7 |
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-2288615-B1 | SELECTIVE CASPASE INHIBITORS AND USES THEREOF | GENESIS TECH LTD (BB) | 2017-06-21 | — | — | EP | disclosed |