Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 3/20 | 0.53 |
| ▸ | MMP9 | P14780 | 1/20 | 0.51 |
| ▸ | MMP8 | P22894 | 1/20 | 0.51 |
| ▸ | CTSC | P53634 | 1/20 | 0.49 |
| ▸ | CTSB | P07858 | 4/20 | 0.48 |
| ▸ | CTSS | P25774 | 4/20 | 0.48 |
| ▸ | CTSK | P43235 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.41 |
| ▸ | MME | P08473 | 2/20 | 0.41 |
| ▸ | ACE | P12821 | 2/20 | 0.41 |
| ▸ | PYGL | P06737 | 1/20 | 0.41 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.41 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.41 |
| ▸ | HSPA9 | P38646 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6443541 | 0.88 | CTSL (0.51) | CTSLMMP9MMP8CTSCCTSB | |
| SCHEMBL6447088 | 0.87 | CTSL (0.68) | CTSLMMP9MMP8CTSBCTSS | |
| SCHEMBL6445846 | 0.85 | CTSL (0.56) | CTSLCTSBCTSSCTSKRAB9A | |
| SCHEMBL6020300 | 0.85 | CTSL (0.62) | CTSLMMP9MMP8CTSBCTSS | |
| SCHEMBL6018993 | 0.82 | MMP9 (0.52) | CTSLMMP9MMP8CTSBCTSS | |
| SCHEMBL6020550 | 0.82 | MMP9 (0.56) | CTSLMMP9MMP8CTSBCTSS | |
| SCHEMBL6020748 | 0.82 | CTSB (0.58) | CTSLMMP9MMP8CTSBCTSS | |
| SCHEMBL6021851 | 0.82 | MMP9 (0.51) | CTSLMMP9MMP8CTSBCTSS | |
| SCHEMBL6442967 | 0.81 | CTSB (0.52) | CTSLMMP9MMP8CTSBCTSS | |
| SCHEMBL6019793 | 0.80 | MMP9 (0.54) | CTSLMMP9MMP8CTSBCTSS |
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 3 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 |