Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 6/20 | 0.33 |
| ▸ | WNT3A | P56704 | 9/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.33 |
| ▸ | EP300 | Q09472 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6166999 | 0.93 | WNT3A (0.32) | HSD11B1WNT3ACREBBPEP300SCN9A | |
| SCHEMBL6626793 | 0.84 | EP300 (0.33) | HSD11B1CREBBPEP300 | |
| SCHEMBL6622375 | 0.83 | CREBBP (0.35) | HSD11B1CREBBPEP300 | |
| SCHEMBL6622826 | 0.82 | EP300 (0.33) | HSD11B1CREBBPEP300 | |
| SCHEMBL6621778 | 0.82 | EP300 (0.33) | HSD11B1WNT3ACREBBPEP300 | |
| SCHEMBL6433725 | 0.79 | EP300 (0.33) | HSD11B1CREBBPEP300 | |
| SCHEMBL6609350 | 0.79 | HSD11B1 (0.36) | HSD11B1CREBBPEP300 | |
| SCHEMBL6608114 | 0.79 | NPY2R (0.35) | HSD11B1CREBBPEP300 | |
| SCHEMBL6624529 | 0.79 | NPY2R (0.35) | HSD11B1CREBBPEP300 | |
| SCHEMBL6435412 | 0.79 | CREBBP (0.36) | HSD11B1CREBBPEP300 |
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 |