Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 19/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL1735068 | 0.79 | CETP (0.50) | CETPKCNH2 | |
| SCHEMBL1734851 | 0.78 | CETP (0.51) | CETPKCNH2 | |
| SCHEMBL3787793 | 0.77 | CETP (0.57) | CETPKCNH2 | |
| SCHEMBL13082829 | 0.75 | CETP (0.56) | CETPKCNH2 | |
| SCHEMBL1735063 | 0.75 | ESR1 (0.54) | CETPKCNH2ESR1ESR2 | |
| SCHEMBL1735106 | 0.75 | CETP (0.54) | CETPKCNH2ESR1ESR2 | |
| SCHEMBL3690878 | 0.75 | CETP (0.76) | CETPKCNH2 | |
| SCHEMBL1736290 | 0.75 | ESR1 (0.51) | CETPKCNH2ESR1ESR2 | |
| SCHEMBL1734951 | 0.75 | CETP (0.52) | CETPKCNH2ESR1ESR2 | |
| SCHEMBL1734615 | 0.75 | CETP (0.51) | CETPKCNH2ESR1ESR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1954287-B2 | CETP INHIBITORS | MERCK SHARP & DOHME (US) | 2016-02-24 | — | — | EP | disclosed |
| EP-1954287-B1 | CETP INHIBITORS | MERCK SHARP & DOHME (US) | 2011-11-16 | — | — | EP | disclosed |
| US-20110262658-A1 | PROCESS AND DEVICE FOR TREATING THE COATING OF THERMOPLASTIC RESIN CONTAINERS | ZOPPAS MATTEO | 2011-10-27 | — | — | US | disclosed |