Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 2/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.49 |
| ▸ | LPAR1 | Q92633 | 5/20 | 0.48 |
| ▸ | LPAR3 | Q9UBY5 | 4/20 | 0.48 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL622149 | 0.99 | CTSB (0.51) | CTSBENPP2LPAR1LPAR3CAPN1 | |
| SCHEMBL622810 | 0.92 | CTSB (0.53) | CTSB | |
| SCHEMBL622823 | 0.91 | CTSB (0.54) | CTSB | |
| SCHEMBL623329 | 0.89 | CTSB (0.54) | CTSB | |
| SCHEMBL623355 | 0.88 | ITGB3 (0.39) | CTSBENPP2LPAR3CAPN1 | |
| SCHEMBL10085515 | 0.88 | ITGB3 (0.50) | ENPP2LPAR3 | |
| SCHEMBL621711 | 0.88 | CTSB (0.54) | CTSBCAPN1 | |
| SCHEMBL622452 | 0.88 | CASP1 (0.45) | CTSB | |
| SCHEMBL10084886 | 0.87 | ITGB3 (0.48) | ENPP2LPAR3 | |
| SCHEMBL10084885 | 0.87 | CASP1 (0.46) | CTSB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012021788-A2 | DIPEPTIDE CALPAIN INHIBITORS | BANYAN BIOMARKERS (US) | 2012-02-16 | — | — | WO | disclosed |
| WO-2012021788-A2 | DIPEPTIDE CALPAIN INHIBITORS | BANYAN BIOMARKERS (US) | 2012-02-16 | — | — | WO | disclosed |