Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR3 | Q9UBY5 | 6/20 | 0.53 |
| ▸ | LPAR1 | Q92633 | 5/20 | 0.53 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL623185 | 0.92 | CYP3A4 (0.54) | CYP3A4MAPK1 | |
| SCHEMBL10085512 | 0.88 | ITGB3 (0.51) | LPAR3LPAR1ENPP2 | |
| SCHEMBL623511 | 0.86 | CNR1 (0.53) | CYP3A4MAPK1 | |
| SCHEMBL623001 | 0.86 | CTSB (0.50) | LPAR3LPAR1ENPP2MAOB | |
| SCHEMBL622149 | 0.85 | CTSB (0.51) | LPAR3LPAR1ENPP2MAOB | |
| SCHEMBL12473614 | 0.84 | CYP3A4 (0.55) | CYP3A4MAPK1MAOB | |
| SCHEMBL623817 | 0.82 | CTSD (0.53) | CYP3A4MAPK1 | |
| SCHEMBL5353206 | 0.80 | LPAR3 (0.61) | LPAR3LPAR1ENPP2MAOB | |
| SCHEMBL5353213 | 0.80 | LPAR3 (0.61) | LPAR3LPAR1ENPP2MAOB | |
| SCHEMBL6452185 | 0.77 | CTSB (0.51) | — |
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-2012021788-A2 | DIPEPTIDE CALPAIN INHIBITORS | BANYAN BIOMARKERS (US) | 2012-02-16 | — | — | WO | disclosed |