Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CTSL | P07711 | 2/20 | 0.37 |
| ▸ | CTSS | P25774 | 2/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 6/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6446381 | 0.92 | SMN1; SMN2 (0.49) | SMN1; SMN2NPC1RAB9ALMNACTSL | |
| SCHEMBL6446717 | 0.89 | CTSK (0.40) | SMN1; SMN2LMNACTSLCTSSCTSK | |
| SCHEMBL6446301 | 0.88 | CTSS (0.46) | SMN1; SMN2NPC1RAB9ALMNACTSL | |
| SCHEMBL6449675 | 0.86 | CTSK (0.39) | NPC1RAB9ACTSLCTSSCTSK | |
| SCHEMBL6442386 | 0.86 | CTSK (0.42) | SMN1; SMN2CTSLCTSSCTSKALOX5 | |
| SCHEMBL6446288 | 0.85 | CTSK (0.39) | LMNACTSLCTSSCTSKTSHR | |
| SCHEMBL6450930 | 0.85 | CTSS (0.36) | CTSLCTSSCTSKALOX5ALDH1A1 | |
| SCHEMBL6443387 | 0.83 | CTSS (0.52) | CTSLCTSSCTSKALOX5 | |
| SCHEMBL6445531 | 0.82 | NPC1 (0.60) | SMN1; SMN2NPC1RAB9ALMNATSHR | |
| SCHEMBL6448203 | 0.80 | CTSS (0.48) | LMNACTSLCTSSCTSKALOX5 |
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 |