Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5668474 | 0.89 | LMNA (0.52) | ALDH1A1KMT2AMEN1PKMLMNA | |
| SCHEMBL5668628 | 0.87 | SMN1; SMN2 (0.41) | TSHRL3MBTL1MAPK1ALDH1A1KMT2A | |
| SCHEMBL5668616 | 0.86 | NEK2 (0.49) | TSHRL3MBTL1MAPK1ALDH1A1POLB | |
| SCHEMBL5666119 | 0.82 | SMN1; SMN2 (0.39) | MAPTPKMLMNAHTTSMN1; SMN2 | |
| SCHEMBL4034055 | 0.80 | L3MBTL1 (0.45) | TSHRL3MBTL1MAPK1RECQLALDH1A1 | |
| SCHEMBL5666460 | 0.79 | ALDH1A1 (0.54) | TSHRL3MBTL1MAPK1ALDH1A1KMT2A | |
| SCHEMBL3919279 | 0.79 | L3MBTL1 (0.44) | TSHRL3MBTL1MAPK1RECQLALDH1A1 | |
| SCHEMBL5668378 | 0.75 | ALDH1A1 (0.57) | TSHRL3MBTL1MAPK1ALDH1A1POLB | |
| SCHEMBL4002141 | 0.74 | KMT2A (0.40) | L3MBTL1RECQLALDH1A1POLBKMT2A | |
| SCHEMBL5668669 | 0.74 | LMNA (0.59) | TSHRL3MBTL1MAPK1ALDH1A1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1730144-A1 | SUBSTITUTED 1,4,8-TRIAZASPIRO¬4.5|DECAN-2-ONE COMPOUNDS | Grünenthal GmbH (DE) | 2006-12-13 | — | — | EP | disclosed |
| WO-2005095398-A1 | SUBSTITUTED 1,4,8-TRIAZASPIRO[4.5]DECAN-2-ONE COMPOUNDS | Grünenthal GmbH (DE) | 2005-10-13 | — | — | WO | disclosed |