Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 7/20 | 0.55 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.44 |
| ▸ | HRH1 | P35367 | 3/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL623798 | 0.99 | CAPN1 (0.54) | CAPN1EPHX2HRH1 | |
| SCHEMBL621465 | 0.84 | CAPN1 (0.52) | CAPN1CASP1CTSD | |
| SCHEMBL621544 | 0.83 | CTSD (0.45) | EPHX2CTSD | |
| SCHEMBL621481 | 0.82 | CAPN1 (0.67) | CAPN1HRH1 | |
| SCHEMBL621480 | 0.82 | CAPN1 (0.67) | CAPN1HRH1 | |
| SCHEMBL623310 | 0.81 | CASP1 (0.47) | CASP1CTSD | |
| SCHEMBL622809 | 0.80 | HDAC1 (0.48) | CASP1CTSD | |
| SCHEMBL23921539 | 0.78 | GPR139 (0.56) | CAPN1CTSD | |
| SCHEMBL21526187 | 0.78 | GPR139 (0.56) | CAPN1CTSD | |
| SCHEMBL21555036 | 0.78 | GPR139 (0.56) | CAPN1CTSD |
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 |