Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HTR6 | P50406 | 11/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | PIK3C3 | Q8NEB9 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.36 |
| ▸ | ENPP1 | P22413 | 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 | |
|---|---|---|---|---|
| SCHEMBL29952621 | 0.94 | CYP2C19 (0.55) | CYP2C19HTR6L3MBTL1METPIK3C3 | |
| SCHEMBL18155085 | 0.87 | CYP2C19 (0.44) | CYP2C19HTR6L3MBTL1METPIK3C3 | |
| SCHEMBL12272025 | 0.83 | L3MBTL1 (0.56) | CYP2C19HTR6L3MBTL1PKM | |
| SCHEMBL1672537 | 0.77 | CYP2C19 (0.58) | CYP2C19HTR6L3MBTL1METPKM | |
| SCHEMBL17394567 | 0.76 | HTR6 (0.58) | CYP2C19HTR6L3MBTL1MET | |
| SCHEMBL21821845 | 0.75 | CYP2C19 (0.56) | CYP2C19HTR6L3MBTL1METPKM | |
| SCHEMBL16516498 | 0.74 | HTR6 (0.50) | CYP2C19HTR6L3MBTL1METPKM | |
| SCHEMBL1683430 | 0.74 | CYP2C19 (0.58) | CYP2C19HTR6L3MBTL1METPKM | |
| SCHEMBL457569 | 0.74 | CYP2C19 (0.58) | CYP2C19HTR6L3MBTL1METPKM | |
| SCHEMBL414843 | 0.74 | CYP2C19 (0.58) | CYP2C19HTR6L3MBTL1METPKM |
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-3283475-B1 | 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES | MERCK PATENT GMBH (DE) | 2019-10-16 | — | — | EP | disclosed |