Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 8/20 | 0.55 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6822574 | 0.91 | CTSL (0.44) | CTSLGPR139ALDH1A1POLBNPC1 | |
| SCHEMBL6448205 | 0.88 | CTSL (0.47) | CTSLCTSSCTSK | |
| SCHEMBL6446814 | 0.85 | CTSL (0.41) | CTSLCTSSCTSK | |
| SCHEMBL6446641 | 0.83 | CTSL (0.64) | CTSLGPR139ALDH1A1POLBNPC1 | |
| SCHEMBL6447552 | 0.80 | CTSK (0.42) | CTSLCTSSCTSK | |
| SCHEMBL6020607 | 0.80 | CTSL (0.64) | CTSLCTSSCTSKTACR1 | |
| SCHEMBL6821937 | 0.79 | CTSK (0.43) | CTSLALDH1A1POLBNPC1CTSS | |
| SCHEMBL6021296 | 0.79 | CTSL (0.38) | CTSLNPC1CTSSCTSKRAB9A | |
| SCHEMBL6021888 | 0.79 | CTSK (0.44) | CTSLPOLBCTSSCTSK | |
| SCHEMBL6446486 | 0.79 | CTSK (0.41) | CTSLALDH1A1NPC1CTSSCTSK |
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 |
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | claimed |
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | disclosed |