Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 2/20 | 0.47 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 9/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 6/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | QPCT | Q16769 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11567387 | 0.91 | GBA1 (0.48) | GBA1CRHR1CNR2CYP2C19CNR1 | |
| SCHEMBL11561974 | 0.87 | HCAR3 (0.45) | GBA1CRHR1CYP2C19AOC3QPCT | |
| SCHEMBL179288 | 0.85 | GBA1 (0.62) | GBA1AOC3KMT2A | |
| SCHEMBL11566506 | 0.84 | GBA1 (0.45) | GBA1CRHR1CNR2CYP2C19TSHR | |
| SCHEMBL11563472 | 0.82 | SLC6A2 (0.40) | GBA1CRHR1CYP2C19QPCTMEN1 | |
| SCHEMBL15075696 | 0.81 | CYP2C19 (0.55) | GBA1CYP2C19CNR1AOC3MEN1 | |
| SCHEMBL11564050 | 0.79 | LMNA (0.43) | CRHR1CYP2C19MEN1KMT2ATSHR | |
| SCHEMBL23183031 | 0.79 | GBA1 (0.50) | GBA1AOC3MEN1KMT2A | |
| SCHEMBL21388440 | 0.79 | HCAR3 (0.50) | GBA1CRHR1AOC3 | |
| SCHEMBL20056973 | 0.74 | HCAR3 (0.57) | GBA1CRHR1AOC3 |
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-0000816-A1 | Substituted amino-pyridine derivatives, processes for their preparation and pharmaceutical compositions containing them | BEECHAM GROUP PLC (GB) | 1979-02-21 | — | — | EP | disclosed |