Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 13/20 | 0.43 |
| ▸ | CTSS | P25774 | 7/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12734600 | 0.81 | CTSK (0.61) | CTSKCTSS | |
| SCHEMBL361540 | 0.81 | TDP1 (0.50) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL31059571 | 0.81 | TDP1 (0.50) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL15961701 | 0.81 | CTSK (0.61) | CTSKCTSS | |
| SCHEMBL12734596 | 0.81 | CTSK (0.61) | CTSKCTSS | |
| SCHEMBL24687980 | 0.81 | TDP1 (0.50) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL25320847 | 0.80 | CA1 (0.47) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL24465592 | 0.80 | CTSK (0.56) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL8270649 | 0.80 | CA1 (0.47) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL12493912 | 0.80 | TDP1 (0.53) | CA1CA2CA7CYP2D6CTSK |
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 |
|---|---|---|---|---|---|---|---|
| CN-1112125-A | Acyloxyhexanoic acid derivatives | CIBA GEIGY AG (CH) | 1995-11-22 | — | — | CN | disclosed |