Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 7/20 | 0.44 |
| ▸ | PTGES | O14684 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4052069 | 0.76 | GRM5 (0.46) | GRM5PTGESKCNH2MAP3K14NPC1 | |
| SCHEMBL5123963 | 0.76 | GRM5 (0.43) | GRM5PTGESKCNH2MAP3K14 | |
| SCHEMBL5115607 | 0.75 | GRM5 (0.46) | GRM5PTGESKCNH2MAP3K14 | |
| SCHEMBL3276812 | 0.74 | GRM5 (0.49) | GRM5PTGESKCNH2MAP3K14 | |
| SCHEMBL1899368 | 0.74 | GRM5 (0.49) | GRM5PTGESKCNH2MAP3K14 | |
| SCHEMBL3840451 | 0.74 | GRM5 (0.48) | GRM5KCNH2NPC1RAB9APOLB | |
| SCHEMBL4046766 | 0.73 | GRM5 (0.41) | GRM5PTGESKCNH2MAP3K14NPC1 | |
| SCHEMBL3838272 | 0.72 | GRM5 (0.50) | GRM5PTGESKCNH2MAP3K14 | |
| SCHEMBL3839812 | 0.72 | GRM5 (0.50) | GRM5PTGESKCNH2MAP3K14 | |
| SCHEMBL5128660 | 0.72 | GRM5 (0.44) | GRM5PTGESKCNH2 |
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-1877365-B1 | ACETYLENE DERIVATIVES | NOVARTIS AG (CH) | 2010-11-10 | — | — | EP | claimed |