Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTH1R | Q03431 | 17/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CCKBR | P32239 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5324905 | 1.00 | PTH1R (0.44) | PTH1RALDH1A1CCKBRCYP2D6 | |
| SCHEMBL5322462 | 0.89 | PTH1R (0.47) | PTH1RCCKBR | |
| SCHEMBL5321548 | 0.85 | PTH1R (0.52) | PTH1RCCKBR | |
| SCHEMBL5320208 | 0.85 | PTH1R (0.52) | PTH1RCCKBR | |
| SCHEMBL5325682 | 0.85 | PTH1R (0.52) | PTH1RCCKBR | |
| SCHEMBL5320173 | 0.85 | PTH1R (0.52) | PTH1RCCKBR | |
| SCHEMBL5323414 | 0.85 | PTH1R (0.47) | PTH1RCCKBR | |
| SCHEMBL5324912 | 0.84 | PTH1R (0.44) | PTH1RALDH1A1CCKBR | |
| SCHEMBL5324706 | 0.83 | PTH1R (0.51) | PTH1RCCKBR | |
| SCHEMBL5324703 | 0.83 | PTH1R (0.51) | PTH1RCCKBR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006129120-A9 | BENZOTRIAZEPINONE DERIVATIVES | JAMES BLACK FOUNDATION (GB) | 2007-03-22 | — | — | WO | disclosed |
| WO-2006129120-A2 | BENZOTRIAZEPINONE DERIVATIVES | JAMES BLACK FOUNDATION (GB) | 2006-12-07 | — | — | WO | disclosed |