Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 2/20 | 0.54 |
| ▸ | CTSB | P07858 | 1/20 | 0.54 |
| ▸ | CTSS | P25774 | 1/20 | 0.54 |
| ▸ | CTSK | P43235 | 1/20 | 0.54 |
| ▸ | REN | P00797 | 5/20 | 0.49 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.48 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.43 |
| ▸ | MAP1LC3A | Q9H492 | 1/20 | 0.43 |
| ▸ | ANPEP | P15144 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15940877 | 0.91 | CTSS (0.44) | CTSLCTSBCTSSCTSKREN | |
| SCHEMBL31433016 | 0.80 | MEN1 (0.50) | ALDH1A1LMNATDP1 | |
| SCHEMBL8418512 | 0.80 | REN (0.65) | CTSLCTSBCTSSCTSKREN | |
| SCHEMBL30690971 | 0.80 | LMNA (0.52) | CTSLCTSBCTSSCTSKREN | |
| SCHEMBL28353211 | 0.80 | LMNA (0.52) | CTSLCTSBCTSSCTSKREN | |
| SCHEMBL29462332 | 0.78 | CTSL (0.54) | CTSLCTSBCTSSCTSKREN | |
| SCHEMBL22522212 | 0.78 | CTSL (0.54) | CTSLCTSBCTSSCTSKREN | |
| SCHEMBL2675118 | 0.76 | ACE (0.56) | CTSLCTSBCTSSCTSK | |
| SCHEMBL2675114 | 0.76 | ACE (0.56) | CTSLCTSBCTSSCTSK | |
| SCHEMBL18560633 | 0.76 | MEN1 (0.49) | ALDH1A1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2953932-A1 | SUBSTITUTED CARBOXYLIC ACID DERIVATIVES AS AGGRECANASE INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS | Merck Patent GmbH (DE) | 2015-12-16 | — | — | EP | disclosed |
| WO-2014121884-A1 | SUBSTITUTED CARBOXYLIC ACID DERIVATIVES AS AGGRECANASE INHIBITORS FOR THE TREATMENT OF OSTEOARTHRITIS | MERCK PATENT GMBH (DE) | 2014-08-14 | — | — | WO | disclosed |