Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 7/20 | 0.42 |
| ▸ | MMP13 | P45452 | 3/20 | 0.42 |
| ▸ | METAP1 | P53582 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | METAP2 | P50579 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | CTSH | P09668 | 1/20 | 0.37 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13500299 | 0.98 | ALDH1A1 (0.41) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL13500292 | 0.97 | ALDH1A1 (0.40) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL13500291 | 0.97 | MMP1 (0.42) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL13500158 | 0.97 | ALDH1A1 (0.40) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL13501752 | 0.93 | MMP1 (0.39) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL13500153 | 0.91 | MMP1 (0.37) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL9456 | 0.87 | ALDH1A1 (0.49) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL13725530 | 0.86 | MMP1 (0.39) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL13500182 | 0.85 | ALDH1A1 (0.47) | ALDH1A1KMT2ALTA4HMMP1MMP13 | |
| SCHEMBL13500293 | 0.84 | MMP1 (0.37) | ALDH1A1KMT2ALTA4HMMP1MMP13 |
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-2335701-A1 | Heterocyclic aspartyl protease inhibitors | Schering Corporation (US) | 2011-06-22 | — | — | EP | disclosed |
| EP-2153832-A2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2010-02-17 | — | — | EP | disclosed |
| EP-1838304-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | SCHERING CORP (US) | 2009-08-19 | — | — | EP | disclosed |
| WO-2005058311-A1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | SCHERING CORPORATION (US) | 2005-06-30 | — | — | WO | disclosed |