Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 3/20 | 0.46 |
| ▸ | HTRA1 | Q92743 | 3/20 | 0.44 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CCR1 | P32246 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10084540 | 0.89 | CTSB (0.48) | CTSBHTRA1ALDH1A1CTSDSMN1; SMN2 | |
| SCHEMBL10084323 | 0.85 | CTSB (0.48) | CTSBHTRA1CTSD | |
| SCHEMBL623259 | 0.85 | CTSB (0.53) | CTSBHTRA1CASP1CTSD | |
| SCHEMBL10084535 | 0.84 | CTSB (0.47) | CTSBHTRA1CASP1CTSDSMN1; SMN2 | |
| SCHEMBL10084324 | 0.84 | CTSB (0.48) | CTSBHTRA1CASP1CTSDSMN1; SMN2 | |
| SCHEMBL10084539 | 0.84 | CTSB (0.53) | CTSBHTRA1CASP1CTSDCCR1 | |
| SCHEMBL623362 | 0.83 | CTSB (0.58) | CTSBCASP1CTSDSMN1; SMN2 | |
| SCHEMBL623363 | 0.82 | CTSB (0.53) | CTSBALDH1A1CASP1CTSDSMN1; SMN2 | |
| SCHEMBL622416 | 0.81 | CTSB (0.54) | CTSBCASP1CTSD | |
| SCHEMBL621818 | 0.81 | CTSB (0.53) | CTSBCASP1CTSDSMN1; SMN2 |
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 |