Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 16/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8562274 | 1.00 | CTSK (0.48) | CTSKCA1CA2CA7CYP2D6 | |
| SCHEMBL8563895 | 0.81 | CA1 (0.38) | CTSKCA1CA2CA7CYP2D6 | |
| SCHEMBL8563890 | 0.81 | CA1 (0.38) | CTSKCA1CA2CA7CYP2D6 | |
| SCHEMBL8563614 | 0.80 | CTSK (0.48) | CTSKCA1CA2CA7 | |
| SCHEMBL8570019 | 0.80 | CTSK (0.48) | CTSKCA1CA2CA7 | |
| SCHEMBL8563616 | 0.80 | CTSK (0.48) | CTSKCA1CA2CA7 | |
| SCHEMBL8561160 | 0.75 | CA1 (0.36) | CTSKCA1CA2CA7CYP2D6 | |
| SCHEMBL8569503 | 0.75 | CYP2D6 (0.39) | CA1CA2CA7CYP2D6 | |
| SCHEMBL8569499 | 0.75 | CYP2D6 (0.39) | CA1CA2CA7CYP2D6 | |
| SCHEMBL8561163 | 0.75 | CA1 (0.36) | CTSKCA1CA2CA7CYP2D6 |
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 |