Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 17/20 | 0.39 |
| ▸ | CTSK | P43235 | 10/20 | 0.39 |
| ▸ | CTSL | P07711 | 9/20 | 0.38 |
| ▸ | CTSB | P07858 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6822996 | 0.89 | CTSS (0.38) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6447218 | 0.87 | CTSS (0.40) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6447728 | 0.87 | NPC1 (0.44) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6443744 | 0.86 | CTSS (0.42) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6443162 | 0.84 | NPC1 (0.50) | CTSSCTSKCTSL | |
| SCHEMBL6443290 | 0.82 | CTSS (0.37) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6447568 | 0.82 | CTSS (0.54) | CTSSCTSKCTSLCTSB | |
| SCHEMBL6443401 | 0.77 | ZDHHC20 (0.30) | — | |
| SCHEMBL6446754 | 0.77 | CTSS (0.40) | CTSSCTSKCTSLCTSBMEN1 | |
| SCHEMBL6446919 | 0.76 | CASP3 (0.49) | CTSSCTSKCTSLCTSBKMT2A |
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 6 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 |
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | 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 |
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | disclosed |