Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 11/20 | 0.51 |
| ▸ | CA2 | P00918 | 11/20 | 0.51 |
| ▸ | CA4 | P22748 | 11/20 | 0.51 |
| ▸ | CA9 | Q16790 | 11/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.45 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.43 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.38 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL3493203 | 0.84 | CA1 (0.45) | CA1CA2CA4CA9ROCK1 | |
| SCHEMBL3491584 | 0.83 | CA1 (0.44) | CA1CA2CA4CA9ROCK1 | |
| SCHEMBL3491371 | 0.81 | CA1 (0.43) | CA1CA2CA4CA9ROCK1 | |
| SCHEMBL3493137 | 0.80 | CA1 (0.42) | CA1CA2CA4CA9ROCK1 | |
| SCHEMBL4287934 | 0.80 | CA1 (0.49) | CA1CA2CA4CA9ROCK1 | |
| SCHEMBL3491917 | 0.79 | CA1 (0.41) | CA1CA2CA4CA9ROCK1 | |
| SCHEMBL3491788 | 0.79 | DPP4 (0.41) | CA1CA2CA4CA9ROCK1 | |
| SCHEMBL3493081 | 0.79 | CA1 (0.49) | CA1CA2CA4CA9ROCK1 | |
| SCHEMBL3492365 | 0.78 | CHRM2 (0.39) | CA1CA2CA4CA9TSHR | |
| SCHEMBL4293386 | 0.78 | CA1 (0.45) | CA1CA2CA4CA9ROCK1 |
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-1984355-A2 | CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION | Takeda Pharmaceutical Company Limited (JP) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007094513-A2 | CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-08-23 | — | — | WO | disclosed |