Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL9 | O00512 | 1/20 | 0.56 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | MGLL | Q99685 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30986864 | 0.90 | MGLL (0.56) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL21097206 | 0.83 | HTR2A (0.61) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL12355356 | 0.83 | HTR2A (0.61) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL31258933 | 0.83 | MGLL (0.52) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL2597348 | 0.83 | HTR2A (0.64) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL763026 | 0.83 | HTR2A (0.64) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL14985547 | 0.82 | HTR2A (0.56) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL2597400 | 0.81 | BCL9 (0.63) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL31011370 | 0.81 | HTR2A (0.55) | BCL9CTNNB1HTR2AMGLLGAA | |
| SCHEMBL278663 | 0.81 | BCL9 (0.62) | BCL9CTNNB1HTR2AMGLLGAA |
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-0429232-A1 | N-substituted derivatives of 3R,4R-ethyl-[(1-methyl-1H-imidazol-5-yl)methyl]-2-pyrrolidinone | ALLERGAN, INC. (US) | 1991-05-29 | — | — | EP | disclosed |