Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 16/20 | 0.77 |
| ▸ | CTSK | P43235 | 14/20 | 0.77 |
| ▸ | CTSB | P07858 | 4/20 | 0.77 |
| ▸ | CTSL | P07711 | 2/20 | 0.77 |
| ▸ | AKT1 | P31749 | 1/20 | 0.67 |
| ▸ | ACE | P12821 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL12204485 | 1.00 | CTSS (0.77) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL7305781 | 0.91 | REN (0.69) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL21010315 | 0.91 | CTSS (0.79) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL10040933 | 0.91 | CTSS (0.79) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL2440946 | 0.91 | CTSS (0.79) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL3383006 | 0.90 | CTSS (0.77) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL2685573 | 0.89 | CTSS (0.63) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL2446582 | 0.88 | CTSS (0.76) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL2793925 | 0.88 | CTSS (0.76) | CTSSCTSKCTSBCTSLAKT1 | |
| SCHEMBL2442760 | 0.88 | CTSS (0.76) | CTSSCTSKCTSBCTSLAKT1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3778653-A1 | NOVEL REACTIVE ALGINIC ACID DERIVATIVES | Mochida Pharmaceutical Co., Ltd. (JP) | 2021-02-17 | — | — | EP | disclosed |
| US-6953788-B1 | 3-mercaptoacetylamino-1,5-substituted-2-oxo-azepan derivatives useful as inhibitors of matrix metalloproteinase | AVENTIS PHARMACEUTICALS INC. (US) | 2005-10-11 | — | — | US | disclosed |