Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.38 |
| ▸ | EP300 | Q09472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 8/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | BRD2 | P25440 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6164987 | 0.91 | SLC6A9 (0.37) | SLC6A9CREBBPEP300GABRA5BRD4 | |
| SCHEMBL6162738 | 0.89 | SLC6A9 (0.41) | SLC6A9CREBBPEP300BRD4BRD2 | |
| SCHEMBL6612867 | 0.81 | NPC1 (0.39) | CREBBPEP300MEN1KMT2A | |
| SCHEMBL6608326 | 0.81 | HDAC3 (0.42) | SLC6A9HPGDMEN1KMT2A | |
| SCHEMBL6165370 | 0.79 | SLC6A9 (0.33) | SLC6A9CREBBPEP300 | |
| SCHEMBL6634587 | 0.78 | GABRA5 (0.44) | CREBBPEP300GABRA5MEN1KMT2A | |
| SCHEMBL6164971 | 0.78 | SLC6A9 (0.33) | SLC6A9CREBBPEP300GABRA5ALOX5AP | |
| SCHEMBL21107455 | 0.77 | SLCO1B1 (0.40) | SLC6A9CREBBPEP300HPGDMEN1 | |
| SCHEMBL6609371 | 0.77 | CREBBP (0.38) | CREBBPEP300MEN1KMT2A | |
| SCHEMBL6607953 | 0.76 | CREBBP (0.38) | CREBBPEP300MEN1KMT2A |
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 |