Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 16/20 | 0.44 |
| ▸ | CTSK | P43235 | 14/20 | 0.44 |
| ▸ | CTSL | P07711 | 2/20 | 0.44 |
| ▸ | CTSB | P07858 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6447493 | 0.87 | CTSS (0.57) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6446718 | 0.86 | CTSS (0.32) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6446773 | 0.82 | ZDHHC20 (0.32) | — | |
| SCHEMBL1304101 | 0.81 | TDP1 (0.53) | CTSSCTSKCTSLCTSBMEN1 | |
| SCHEMBL6442039 | 0.80 | SMN1; SMN2 (0.36) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6444978 | 0.79 | CTSS (0.42) | CTSSCTSKCTSLCTSBMEN1 | |
| SCHEMBL6445291 | 0.78 | ACHE (0.42) | — | |
| SCHEMBL6019683 | 0.77 | CTSS (0.62) | CTSSCTSKCTSLCTSB | |
| SCHEMBL15764468 | 0.77 | CTSS (0.62) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6445034 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | claimed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | claimed |
| EP-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | disclosed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | disclosed |