Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 7/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | GLB1 | P16278 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | LSS | P48449 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL25049533 | 0.90 | DRD3 (0.45) | SIGMAR1 | |
| SCHEMBL16341416 | 0.88 | BCHE (0.46) | BCHEBACE1 | |
| SCHEMBL9528068 | 0.87 | BCHE (0.51) | BCHEGBA1BACE1LSS | |
| SCHEMBL2433914 | 0.86 | BCHE (0.49) | BCHEGBA1GLB1 | |
| Hydrochloric Acid SCHEMBL30212680 | 0.86 | BCHE (0.45) | BCHEBACE1 | |
| SCHEMBL2433913 | 0.86 | BCHE (0.49) | BCHEGBA1GLB1 | |
| Fluoride SCHEMBL29253011 | 0.86 | CYP1A2 (0.48) | BCHEBACE1LSS | |
| SCHEMBL9344937 | 0.85 | GNAO1 (0.50) | BCHEGBA1 | |
| Hydrochloric Acid SCHEMBL11479066 | 0.84 | BCHE (0.49) | BCHEBACE1LSS | |
| Cyanide SCHEMBL30329990 | 0.83 | BCHE (0.43) | BCHEBACE1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0600955-A1 | 5-HT4 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-06-15 | — | — | EP | disclosed |
| WO-1993003725-A1 | 5-HT4 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-03-04 | — | — | WO | disclosed |