Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.30 |
| ▸ | CTSB | P07858 | 1/20 | 0.30 |
| ▸ | CTSS | P25774 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23810245 | 0.85 | ACACB (0.33) | ACACBCTSLCTSBCTSS | |
| SCHEMBL20341776 | 0.84 | ACACB (0.32) | ACACBCTSLCTSBCTSS | |
| SCHEMBL18615855 | 0.84 | CTSL (0.36) | ACACBCTSLCTSBCTSS | |
| SCHEMBL20341821 | 0.82 | CTSL (0.40) | CTSLCTSBCTSS | |
| SCHEMBL23810241 | 0.82 | CTSL (0.40) | CTSLCTSBCTSS | |
| SCHEMBL20341849 | 0.76 | CTSL (0.38) | ACACBCTSLCTSBCTSS | |
| SCHEMBL23810282 | 0.75 | CTSL (0.42) | ACACBCTSLCTSBCTSS | |
| SCHEMBL18616645 | 0.74 | CTSS (0.39) | CTSLCTSBCTSS | |
| SCHEMBL23810242 | 0.74 | NAMPT (0.40) | — | |
| SCHEMBL20341836 | 0.74 | SPHK1 (0.33) | — |
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-2017036357-A1 | CATHEPSIN K INHIBITOR AND APPLICATION THEREOF | 广东东阳光药业有限公司 | 2017-03-09 | — | — | WO | disclosed |