Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTH1R | Q03431 | 3/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5319865 | 0.90 | PTH1R (0.37) | PTH1RCHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5320857 | 0.90 | PTH1R (0.36) | PTH1RCHRM1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5326307 | 0.84 | PTH1R (0.49) | PTH1RCHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5327534 | 0.83 | PTH1R (0.51) | PTH1RCHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5332531 | 0.82 | PTH1R (0.44) | PTH1RCHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL5319651 | 0.80 | PTH1R (0.37) | PTH1RCHRM1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5323969 | 0.78 | LMNA (0.31) | CNR2 | |
| SCHEMBL5322785 | 0.78 | CES2 (0.42) | PTH1RCHRM1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5331038 | 0.78 | CES2 (0.42) | PTH1RCHRM1KDM4EALDH1A1HSD17B10 | |
| SCHEMBL5285662 | 0.78 | CES2 (0.42) | PTH1RCHRM1KDM4EALDH1A1HSD17B10 |
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 |