Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 13/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3378683 | 1.00 | GRM5 (0.44) | GRM5EPHX2NPC1TP53RAB9A | |
| SCHEMBL992650 | 0.85 | NPC1 (0.45) | GRM5NPC1TP53RAB9AKMT2A | |
| SCHEMBL990862 | 0.85 | NPC1 (0.45) | GRM5NPC1TP53RAB9AKMT2A | |
| SCHEMBL3377013 | 0.85 | GRM5 (0.46) | GRM5EPHX2NPC1RAB9AKMT2A | |
| SCHEMBL3375912 | 0.85 | GRM5 (0.46) | GRM5EPHX2NPC1RAB9AKMT2A | |
| SCHEMBL3373475 | 0.84 | GRM5 (0.44) | GRM5EPHX2NPC1RAB9AL3MBTL1 | |
| SCHEMBL3378678 | 0.84 | GRM5 (0.44) | GRM5EPHX2NPC1RAB9AL3MBTL1 | |
| SCHEMBL3374841 | 0.82 | GRM5 (0.44) | GRM5EPHX2RAB9A | |
| SCHEMBL3412769 | 0.81 | GRM5 (0.46) | GRM5 | |
| SCHEMBL3377248 | 0.81 | GRM5 (0.46) | GRM5 |
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 |