Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL3836958 | 0.88 | PARP1 (0.36) | PARP1CHRNB2CHRNA4 | |
| SCHEMBL3839251 | 0.85 | PARP1 (0.33) | PARP1 | |
| SCHEMBL3837642 | 0.85 | PARP1 (0.37) | PARP1 | |
| SCHEMBL3837309 | 0.83 | PARP1 (0.40) | PARP1 | |
| SCHEMBL3839402 | 0.82 | HRH3 (0.43) | PARP1 | |
| SCHEMBL3836776 | 0.80 | AURKA (0.34) | JAK3 | |
| SCHEMBL3839331 | 0.79 | KDR (0.32) | — | |
| SCHEMBL3837343 | 0.77 | L3MBTL1 (0.39) | PARP1 | |
| SCHEMBL3837174 | 0.77 | KDR (0.34) | — | |
| SCHEMBL3836696 | 0.76 | CLK4 (0.32) | — |
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-2108642-A1 | JAK INHIBITOR | Kyowa Hakko Kirin Co., Ltd. (JP) | 2009-10-14 | — | — | EP | disclosed |