Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | REN | P00797 | 2/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 4/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.33 |
| ▸ | ACP1 | P24666 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3494053 | 0.91 | CA1 (0.45) | CA1CA2CA4CA9REN | |
| SCHEMBL8235482 | 0.90 | CA1 (0.46) | CA1CA2CA4CA9REN | |
| SCHEMBL3492601 | 0.86 | CA1 (0.46) | CA1CA2CA4CA9REN | |
| SCHEMBL3492519 | 0.86 | CA1 (0.38) | CA1CA2CA4CA9 | |
| SCHEMBL3493143 | 0.85 | CA1 (0.45) | CA1CA2CA4CA9REN | |
| SCHEMBL13340414 | 0.82 | ABHD6 (0.41) | CA1CA2CA4CA9DPP4 | |
| SCHEMBL8230129 | 0.81 | CA1 (0.52) | CA1CA2CA4CA9REN | |
| SCHEMBL8238490 | 0.79 | CA1 (0.55) | CA1CA2CA4CA9REN | |
| SCHEMBL8236468 | 0.79 | CA1 (0.55) | CA1CA2CA4CA9REN | |
| Hydrochloric Acid SCHEMBL3495102 | 0.78 | CA1 (0.54) | CA1CA2CA4CA9REN |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |