Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7143546 | 0.93 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2TP53MAPTTSHR | |
| SCHEMBL7704777 | 0.91 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2TP53MAPTTSHR | |
| SCHEMBL7146199 | 0.85 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2TP53MAPTTSHR | |
| SCHEMBL7704182 | 0.84 | CYP3A4 (0.35) | ALDH1A1SMN1; SMN2TP53MAPTTSHR | |
| SCHEMBL7705335 | 0.83 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2TP53MAPTTSHR | |
| SCHEMBL7703856 | 0.81 | CYP3A4 (0.37) | ALDH1A1SMN1; SMN2TP53MAPTTSHR | |
| SCHEMBL7141959 | 0.79 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2TP53MAPTTSHR | |
| SCHEMBL7703510 | 0.78 | VCP (0.41) | — | |
| SCHEMBL7704530 | 0.78 | DHODH (0.37) | ALDH1A1 | |
| SCHEMBL7704536 | 0.77 | DHODH (0.36) | ALDH1A1SMN1; SMN2MAPT |
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-1224174-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-07-24 | — | — | EP | disclosed |
| WO-2001029011-A2 | BENZODIAZEPINE DERIVATIVES AS METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-04-26 | — | — | WO | disclosed |