Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 12/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LATS1 | O95835 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3654678 | 0.90 | GSK3B (0.44) | GSK3BCYP2D6 | |
| SCHEMBL4391908 | 0.87 | MEN1 (0.42) | GSK3BCYP2D6RAB9ANPC1MEN1 | |
| SCHEMBL3402354 | 0.85 | RAB9A (0.36) | GSK3BCYP2D6RAB9ANPC1MEN1 | |
| SCHEMBL3662618 | 0.85 | ALDH1A1 (0.44) | GSK3BCYP2D6KMT2ATSHRALDH1A1 | |
| SCHEMBL3663404 | 0.85 | GSK3B (0.41) | GSK3BCYP2D6 | |
| SCHEMBL3661663 | 0.84 | GSK3B (0.42) | GSK3BCYP2D6TSHR | |
| SCHEMBL3663942 | 0.83 | KCNMA1 (0.44) | GSK3BHPGDALDH1A1POLB | |
| SCHEMBL3658243 | 0.83 | GSK3B (0.40) | GSK3BCYP2D6RAB9ANPC1 | |
| SCHEMBL3659720 | 0.81 | GSK3B (0.45) | GSK3BCYP2D6MEN1KMT2A | |
| SCHEMBL3661594 | 0.79 | GSK3B (0.40) | GSK3BCYP2D6 |
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-2238140-A2 | SUBSTITUTED HETEROARYLAMIDE DIAZEPINOPYRIMIDONE DERIVATIVES | Sanofi-Aventis (FR) | 2010-10-13 | — | — | EP | disclosed |
| WO-2009095792-A2 | SUBSTITUTED HETEROARYLAMIDE DIAZEPINOPYRIMIDONE DERIVATIVES | SANOFI-AVENTIS (FR) | 2009-08-06 | — | — | WO | disclosed |