Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | UGCG | Q16739 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6165283 | 0.90 | NOTUM (0.34) | NOTUMSCN9ACYP3A4TP53MAPT | |
| SCHEMBL7704182 | 0.89 | CYP3A4 (0.35) | NOTUMCYP3A4TP53MAPTRXFP1 | |
| SCHEMBL7705397 | 0.82 | KMT2A (0.40) | NOTUMMAPTMEN1KMT2AKEAP1 | |
| SCHEMBL7139910 | 0.81 | CYP3A4 (0.34) | NOTUMCYP3A4ALDH1A1KEAP1SMN1; SMN2 | |
| SCHEMBL6610284 | 0.81 | VCP (0.39) | POLBUGCG | |
| SCHEMBL7705335 | 0.78 | ALDH1A1 (0.44) | POLBCYP3A4TP53MAPTALDH1A1 | |
| SCHEMBL6167305 | 0.78 | ABL1 (0.40) | CYP3A4UGCG | |
| SCHEMBL7704777 | 0.78 | ALDH1A1 (0.39) | CYP3A4TP53MAPTRXFP1ALDH1A1 | |
| SCHEMBL6622928 | 0.77 | HSD11B1 (0.33) | SCN9A | |
| SCHEMBL7528469 | 0.77 | KEAP1 (0.41) | NOTUMCYP3A4MAPTALDH1A1MEN1 |
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 |