Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.39 |
| ▸ | CTSB | P07858 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.36 |
| ▸ | LPAR3 | Q9UBY5 | 4/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10085515 | 0.91 | ITGB3 (0.50) | ITGB3ITGA2BACACBLPAR3ENPP2 | |
| SCHEMBL622452 | 0.90 | CASP1 (0.45) | CTSBCASP1CTSD | |
| SCHEMBL10084886 | 0.90 | ITGB3 (0.48) | ITGB3ITGA2BACACBLPAR3ENPP2 | |
| SCHEMBL10084885 | 0.89 | CASP1 (0.46) | CTSBCASP1CTSD | |
| SCHEMBL623001 | 0.88 | CTSB (0.50) | CTSBCAPN1LPAR3ENPP2 | |
| SCHEMBL621504 | 0.87 | CTSB (0.44) | CTSB | |
| SCHEMBL622149 | 0.87 | CTSB (0.51) | CTSBCAPN1LPAR3ENPP2 | |
| SCHEMBL623002 | 0.87 | HTRA1 (0.40) | ITGB3ITGA2BCTSBHDAC8ACACB | |
| SCHEMBL622356 | 0.86 | CTSB (0.45) | CTSBCTSD | |
| SCHEMBL622810 | 0.86 | CTSB (0.53) | CTSBCTSD |
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 |