Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCK | P35557 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL4441301 | 0.90 | ALDH1A1 (0.31) | ALDH1A1HTTNPSR1 | |
| SCHEMBL1077299 | 0.88 | GCK (0.33) | GCKKCNH2 | |
| SCHEMBL4444174 | 0.87 | GCK (0.34) | GCK | |
| SCHEMBL1077556 | 0.86 | GCK (0.33) | GCK | |
| SCHEMBL1677249 | 0.86 | GCK (0.33) | GCK | |
| SCHEMBL1078345 | 0.86 | GCK (0.34) | GCKKCNH2 | |
| SCHEMBL1677356 | 0.85 | GCK (0.32) | GCK | |
| SCHEMBL1077558 | 0.85 | GCK (0.32) | GCKKCNH2 | |
| SCHEMBL13665423 | 0.83 | GCK (0.34) | GCK | |
| SCHEMBL4440677 | 0.82 | GCK (0.33) | GCK |
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-2009125873-A1 | FUSED RING COMPOUNDS AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-10-15 | — | — | WO | disclosed |