Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 11/20 | 0.74 |
| ▸ | PIN1 | Q13526 | 4/20 | 0.51 |
| ▸ | CTSL | P07711 | 1/20 | 0.51 |
| ▸ | CTSB | P07858 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7787781 | 0.91 | CAPN1 (0.72) | CAPN1PIN1CTSLCTSBRELA | |
| SCHEMBL7789890 | 0.85 | CAPN1 (1.00) | CAPN1CTSLCTSB | |
| SCHEMBL7789887 | 0.85 | CAPN1 (1.00) | CAPN1CTSLCTSB | |
| SCHEMBL7787838 | 0.84 | MAPK1 (0.56) | CAPN1PIN1CTSLCTSBRELA | |
| SCHEMBL7789989 | 0.83 | NR1H4 (0.58) | CAPN1PIN1 | |
| SCHEMBL7789992 | 0.83 | NR1H4 (0.58) | CAPN1PIN1 | |
| SCHEMBL7789993 | 0.82 | NR1H4 (0.62) | CAPN1PIN1 | |
| SCHEMBL14143122 | 0.81 | CAPN1 (0.73) | CAPN1CTSLCTSB | |
| SCHEMBL7787801 | 0.81 | CAPN1 (0.58) | CAPN1PIN1CTSLCTSB | |
| SCHEMBL7789863 | 0.81 | CAPN1 (0.72) | CAPN1PIN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6251917-B1 | Benzamidoaldehydes and their use as cysteine protease inhibitors | BASF AKTIENGESELLSCHAFT (DE) | 2001-06-26 | — | — | US | disclosed |