Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | SHBG | P04278 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12531024 | 0.83 | — | — | |
| SCHEMBL25520926 | 0.83 | — | — | |
| SCHEMBL102859 | 0.78 | — | — | |
| SCHEMBL2700308 | 0.78 | TSHR (0.64) | TSHREPHX2SHBGESR2THRB | |
| SCHEMBL3389566 | 0.78 | TSHR (0.64) | TSHREPHX2SHBGESR2THRB | |
| SCHEMBL24637544 | 0.78 | — | — | |
| SCHEMBL60658 | 0.78 | — | — | |
| SCHEMBL21017223 | 0.78 | — | — | |
| SCHEMBL28182 | 0.78 | — | — | |
| SCHEMBL1593359 | 0.78 | TSHR (0.64) | TSHREPHX2SHBGESR2THRB |
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-3223820-B1 | 3-METHYL-2-IMINO-HEXAHYDRO-1H-PYRANO[3,4-D]PYRIMIDIN-4-ONE COMPOUNDS AS BACE INHIBITORS, COMPOSITIONS, AND THEIR USE | MERCK SHARP & DOHME (US) | 2020-07-22 | — | — | EP | disclosed |