Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.36 |
| ▸ | VNN1 | O95497 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6163633 | 0.87 | GSK3B (0.38) | GSK3BGRM5MEN1KMT2AGPR139 | |
| SCHEMBL6612119 | 0.85 | GSK3B (0.40) | GSK3BGRM5MEN1KMT2ARAB9A | |
| SCHEMBL7700583 | 0.82 | GSK3B (0.43) | GSK3BGRM5MEN1KMT2ARAB9A | |
| SCHEMBL6612157 | 0.82 | ALDH1A1 (0.37) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL6165733 | 0.78 | GSK3B (0.39) | GSK3BGRM5RAB9AALDH1A1LMNA | |
| SCHEMBL7463263 | 0.77 | GPR139 (0.45) | GSK3BGRM5KMT2ARAB9AGPR139 | |
| SCHEMBL6624974 | 0.77 | KAT6A (0.40) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL7459390 | 0.77 | GSK3B (0.46) | GSK3BGRM5KMT2ARAB9AGPR139 | |
| SCHEMBL6638781 | 0.76 | GSK3B (0.41) | GSK3BGRM5GPR139ALDH1A1MAPT | |
| SCHEMBL6165176 | 0.76 | GSK3B (0.39) | GSK3BGRM5ALDH1A1KDM4ELMNA |
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 |