Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 8/20 | 0.41 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2419336 | 0.87 | BRD9 (0.41) | BRD9KCNH2GRIN1GRIN2BFYN | |
| SCHEMBL1499387 | 0.82 | NTRK1 (0.50) | FYN | |
| SCHEMBL1499372 | 0.80 | LCK (0.54) | — | |
| SCHEMBL2416274 | 0.78 | HCRTR1 (0.43) | GRM5HAO1 | |
| SCHEMBL3054046 | 0.77 | PTGS1 (0.47) | — | |
| SCHEMBL3054044 | 0.74 | GAA (0.50) | FYNNR3C1 | |
| SCHEMBL1499154 | 0.73 | LCK (0.51) | FYN | |
| SCHEMBL1499144 | 0.73 | NTRK1 (0.51) | FYN | |
| SCHEMBL1499307 | 0.72 | FGFR1 (0.48) | — | |
| SCHEMBL1499286 | 0.72 | BRAF (0.54) | — |
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-2229389-B1 | ALKYNYLARYL COMPOUNDS AND SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, METHODS OF PREPARING SAME AND USES OF SAME | Bayer Pharma AG (DE) | 2011-09-14 | — | — | EP | claimed |