Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 2/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | CTSD | P07339 | 1/20 | 0.43 |
| ▸ | ACACB | O00763 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 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 | |
|---|---|---|---|---|
| SCHEMBL12473613 | 0.87 | CTSB (0.47) | CTSBCASP1ACACB | |
| SCHEMBL18262577 | 0.87 | LDHA (0.57) | CTSBLDHAACACBALDH1A1 | |
| SCHEMBL20204722 | 0.86 | CTSB (0.62) | CTSB | |
| SCHEMBL12475011 | 0.85 | CTSB (0.59) | CTSBMMP9 | |
| SCHEMBL10084585 | 0.85 | CTSB (0.62) | CTSBCTSD | |
| SCHEMBL7806376 | 0.85 | CTSB (0.62) | CTSBCTSD | |
| SCHEMBL623793 | 0.85 | ALDH1A1 (0.54) | CTSBCASP1CTSDALDH1A1MMP3 | |
| SCHEMBL10084885 | 0.83 | CASP1 (0.46) | CTSBCASP1CTSDALDH1A1 | |
| SCHEMBL29537416 | 0.82 | CTSD (0.50) | CASP1CTSDMMP1MMP2MMP3 | |
| SCHEMBL622452 | 0.82 | CASP1 (0.45) | CTSBCASP1CTSDALDH1A1 |
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 |