Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.53 |
| ▸ | ECE1 | P42892 | 7/20 | 0.51 |
| ▸ | MME | P08473 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | CTSS | P25774 | 5/20 | 0.47 |
| ▸ | CTSK | P43235 | 4/20 | 0.47 |
| ▸ | CTSB | P07858 | 3/20 | 0.47 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | TACR1 | P25103 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7962462 | 1.00 | KLK5 (0.53) | KLK5ECE1MMEMEN1KMT2A | |
| SCHEMBL7962403 | 0.90 | ECE1 (0.60) | ECE1MMEMEN1KMT2ACTSS | |
| SCHEMBL7972346 | 0.90 | ECE1 (0.60) | ECE1MMEMEN1KMT2ACTSS | |
| SCHEMBL7972340 | 0.87 | ECE1 (0.44) | KLK5ECE1MMEMEN1KMT2A | |
| SCHEMBL7972405 | 0.85 | ECE1 (0.55) | ECE1MMEMEN1KMT2ATACR1 | |
| SCHEMBL7975670 | 0.85 | ECE1 (0.55) | ECE1MMEMEN1KMT2ATACR1 | |
| SCHEMBL5630007 | 0.80 | CTSS (0.69) | KLK5MEN1KMT2ACTSSCTSK | |
| SCHEMBL31584535 | 0.80 | CTSS (0.69) | KLK5MEN1KMT2ACTSSCTSK | |
| SCHEMBL7976231 | 0.79 | ECE1 (0.49) | ECE1MMEMEN1KMT2AKDR | |
| SCHEMBL5115337 | 0.79 | CA12 (0.49) | KLK5KMT2AEPHX2CTSSCTSK |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001077095-A2 | DERIVATIVES OF ALPHA-MERCAPTOACETAMIDE | NOVARTIS AG (CH) | 2001-10-18 | — | — | WO | disclosed |