Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.61 |
| ▸ | CA1 | P00915 | 3/20 | 0.61 |
| ▸ | CTSK | P43235 | 6/20 | 0.44 |
| ▸ | BIRC2 | Q13490 | 3/20 | 0.41 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28240301 | 0.92 | CA1 (0.49) | CA2CA1CTSKBIRC2ZDHHC7 | |
| SCHEMBL25917050 | 0.92 | CA1 (0.49) | CA2CA1CTSKBIRC2ZDHHC7 | |
| SCHEMBL6860015 | 0.90 | CA2 (0.46) | CA2CA1CTSKBIRC2CTSS | |
| SCHEMBL580040 | 0.86 | CA2 (0.69) | CA2CA1BIRC2ZDHHC7MAPK1 | |
| SCHEMBL6860859 | 0.86 | CA2 (0.69) | CA2CA1BIRC2ZDHHC7MAPK1 | |
| SCHEMBL1915651 | 0.83 | CA2 (0.55) | CA2CA1CTSKCTSSMAPK1 | |
| SCHEMBL15116512 | 0.83 | CTSK (0.43) | CA2CA1CTSKBIRC2CTSS | |
| SCHEMBL6870423 | 0.83 | CA2 (0.65) | CA2CA1BIRC2ZDHHC7MAPK1 | |
| SCHEMBL1915653 | 0.83 | CA2 (0.55) | CA2CA1CTSKCTSSMAPK1 | |
| SCHEMBL4835503 | 0.82 | FOLH1 (0.39) | CA2CA1CYP2D6 |
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-2006114401-A2 | NOVEL CYCLIC AMINES | F. HOFFMANN-LA ROCHE AG (CH) | 2006-11-02 | — | — | WO | disclosed |