Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NMT2 | O60551 | 17/20 | 0.72 |
| ▸ | NMT1 | P30419 | 17/20 | 0.72 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.49 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL6864133 | 0.90 | NMT2 (0.59) | NMT2NMT1ADRB2ADRB1ADRB3 | |
| SCHEMBL6874419 | 0.89 | NMT2 (0.75) | NMT2NMT1 | |
| SCHEMBL3471356 | 0.84 | NMT2 (1.00) | NMT2NMT1ADRB2ADRB1ADRB3 | |
| SCHEMBL6868611 | 0.83 | NMT2 (0.64) | NMT2NMT1 | |
| SCHEMBL6870237 | 0.82 | NMT2 (0.70) | NMT2NMT1ADRB2ADRB1ADRB3 | |
| Hydrochloric Acid SCHEMBL6869324 | 0.80 | NMT2 (0.49) | NMT2NMT1ADRB2ADRB1ADRB3 | |
| SCHEMBL6870479 | 0.80 | NMT2 (0.76) | NMT2NMT1 | |
| SCHEMBL6870905 | 0.80 | MAOB (0.49) | NMT2NMT1 | |
| SCHEMBL6868394 | 0.80 | NMT2 (0.71) | NMT2NMT1ADRB2ADRB1ADRB3 | |
| SCHEMBL6868285 | 0.79 | NMT2 (0.72) | NMT2NMT1ADRB2ADRB1ADRB3 |
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-1379522-A1 | DIHYDRO-BENZO(b)(1,4)DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS I | F. HOFFMANN-LA ROCHE AG (CH) | 2004-01-14 | — | — | EP | disclosed |
| WO-2002083665-A1 | DIHYDRO-BENZO[b][1,4]DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS I | F. HOFFMANN-LA ROCHE AG (CH) | 2002-10-24 | — | — | WO | disclosed |