Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 16/20 | 0.50 |
| ▸ | CTSK | P43235 | 13/20 | 0.50 |
| ▸ | CTSB | P07858 | 6/20 | 0.50 |
| ▸ | CTSL | P07711 | 4/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6445274 | 0.91 | CTSS (0.60) | CTSSCTSKCTSBCTSL | |
| SCHEMBL6447648 | 0.89 | MTNR1A (0.40) | CTSSCTSKCTSBCTSL | |
| SCHEMBL6445439 | 0.87 | CTSS (0.56) | CTSSCTSKCTSBCTSL | |
| SCHEMBL6443381 | 0.87 | CYP2D6 (0.40) | CTSSCTSKCTSBCTSL | |
| SCHEMBL6446829 | 0.85 | CTSS (0.38) | CTSSCTSKCTSBCTSL | |
| SCHEMBL6443928 | 0.85 | CTSK (0.41) | CTSSCTSKCTSBCTSL | |
| SCHEMBL6819019 | 0.84 | CTSS (0.48) | CTSSCTSKCTSBCTSLNQO2 | |
| SCHEMBL6575223 | 0.84 | CTSS (0.46) | CTSSCTSKCTSBACACBGABRB1 | |
| SCHEMBL6445255 | 0.83 | NPC1 (0.44) | CTSSCTSKCTSBCTSL | |
| SCHEMBL6165666 | 0.83 | CTSS (0.44) | CTSSCTSKCTSBACACBGABRB1 |
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 |