Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.56 |
| ▸ | MAOA | P21397 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RAD52 | P43351 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | HTR2B | P41595 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3159301 | 1.00 | ACHE (0.56) | ACHEMAOATSHRCYP3A4MAPT | |
| Ammonia Solution, Strong SCHEMBL3835907 | 0.98 | ACHE (0.55) | ACHEMAOATSHRCYP3A4MAPT | |
| SCHEMBL19313233 | 0.88 | MAOA (0.57) | ACHEMAOATSHRRAD52HTR2A | |
| SCHEMBL19245725 | 0.84 | ACHE (0.63) | ACHEMAOA | |
| SCHEMBL19245724 | 0.84 | ACHE (0.63) | ACHEMAOA | |
| SCHEMBL10202241 | 0.80 | ACHE (0.50) | ACHEMAOATSHRCYP3A4MAPT | |
| SCHEMBL5386000 | 0.79 | MAOA (0.61) | MAOATSHRHTR2AHTR2CHTR2B | |
| SCHEMBL20646082 | 0.77 | CYP3A4 (0.48) | ACHEMAOATSHRCYP3A4MAPT | |
| SCHEMBL7936406 | 0.77 | CYP3A4 (0.48) | ACHEMAOATSHRCYP3A4MAPT | |
| SCHEMBL12182121 | 0.77 | CYP3A4 (0.48) | ACHEMAOATSHRCYP3A4MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009066041-A2 | DERIVATIVES OF 1,2,4,5-TETRAHYDRO-3H-BENZAZEPINES, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | LES LABORATOIRES SERVIER (FR) | 2009-05-28 | — | — | WO | disclosed |
| EP-1589005-B1 | Process for the synthesis of Ivabradine and its pharmaceutically acceptable acid addition salts | SERVIER LAB (FR) | 2007-03-28 | — | — | EP | disclosed |
| EP-0534859-A1 | Benzocyclobutyl- or indanyl-alkyl-amino-alkyl substituted 3-benzazepin-2-ones useful in the treatment of cardiovascular diseases | ADIR ET COMPAGNIE (FR) | 1993-03-31 | — | — | EP | disclosed |