Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6166900 | 0.89 | CYP3A4 (0.55) | CYP3A4 | |
| SCHEMBL6165499 | 0.84 | CYP3A4 (0.55) | CYP3A4 | |
| SCHEMBL6433551 | 0.84 | CYP3A4 (0.67) | CYP3A4 | |
| SCHEMBL6164338 | 0.83 | CYP3A4 (0.60) | CYP3A4 | |
| SCHEMBL6164688 | 0.83 | CYP3A4 (0.56) | CYP3A4 | |
| SCHEMBL6433608 | 0.83 | GRM2 (0.70) | CYP3A4 | |
| SCHEMBL6433387 | 0.82 | CYP3A4 (0.62) | CYP3A4 | |
| SCHEMBL6434645 | 0.82 | GRM2 (0.73) | CYP3A4 | |
| SCHEMBL6164415 | 0.78 | CYP3A4 (0.55) | CYP3A4 | |
| SCHEMBL6165350 | 0.75 | CYP3A4 (0.55) | CYP3A4 |
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-1379511-A1 | DIHYDRO-BENZO (b) (1, 4) DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II | F. HOFFMANN-LA ROCHE AG (CH) | 2004-01-14 | — | — | EP | disclosed |
| WO-2002083652-A1 | DIHYDRO-BENZO [b] [1, 4] DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II | F. HOFFMANN-LA ROCHE AG (CH) | 2002-10-24 | — | — | WO | disclosed |