Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.30 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12830882 | 0.86 | — | — | |
| SCHEMBL12756466 | 0.86 | SIRT1 (0.40) | SIRT1 | |
| SCHEMBL12830883 | 0.84 | AKR1C3 (0.35) | — | |
| SCHEMBL12830881 | 0.81 | HTT (0.33) | — | |
| SCHEMBL12830900 | 0.81 | TMIGD3 (0.38) | — | |
| SCHEMBL12830886 | 0.74 | MAOA (0.33) | — | |
| SCHEMBL12830899 | 0.74 | NPC1 (0.31) | — | |
| SCHEMBL12830903 | 0.74 | HSD17B10 (0.38) | — | |
| SCHEMBL1907728 | 0.72 | MEN1 (0.41) | SIRT1 | |
| SCHEMBL15480523 | 0.72 | AKR1C3 (0.41) | — |
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-2011034962-A2 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA INC. (US) | 2011-03-24 | — | — | WO | disclosed |