Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | REN | P00797 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8569503 | 1.00 | CYP2D6 (0.39) | CYP2D6KLK5CA1CA2CA7 | |
| SCHEMBL8562926 | 0.83 | CYP2D6 (0.39) | CYP2D6KLK5CA1CA2CA7 | |
| SCHEMBL8562922 | 0.83 | CYP2D6 (0.39) | CYP2D6KLK5CA1CA2CA7 | |
| SCHEMBL8564574 | 0.83 | CYP2D6 (0.39) | CYP2D6KLK5CA1CA2CA7 | |
| SCHEMBL8561160 | 0.81 | CA1 (0.36) | CYP2D6KLK5CA1CA2CA7 | |
| SCHEMBL8561163 | 0.81 | CA1 (0.36) | CYP2D6KLK5CA1CA2CA7 | |
| SCHEMBL8565477 | 0.80 | CA1 (0.38) | CYP2D6KLK5CA1CA2CA7 | |
| SCHEMBL8565474 | 0.80 | CA1 (0.38) | CYP2D6KLK5CA1CA2CA7 | |
| SCHEMBL8270788 | 0.76 | CA1 (0.49) | CYP2D6CA1CA2CA7REN | |
| SCHEMBL8562274 | 0.75 | CTSK (0.48) | CYP2D6CA1CA2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5719141-A | HYPOTENSIVE AGENTS | NOVARTIS CORPORATION (US) | 1998-02-17 | — | — | US | disclosed |