Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 12/20 | 0.60 |
| ▸ | CTSB | P07858 | 6/20 | 0.46 |
| ▸ | CTSS | P25774 | 6/20 | 0.41 |
| ▸ | CTSK | P43235 | 5/20 | 0.41 |
| ▸ | CTSL | P07711 | 3/20 | 0.41 |
| ▸ | SNCA | P37840 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7787050 | 1.00 | CAPN1 (0.60) | CAPN1CTSBCTSSCTSKCTSL | |
| SCHEMBL7382236 | 0.84 | CAPN1 (0.84) | CAPN1CTSBCTSSCTSKCTSL | |
| SCHEMBL7782222 | 0.84 | CAPN1 (0.84) | CAPN1CTSBCTSSCTSKCTSL | |
| Hydrochloric Acid SCHEMBL7787790 | 0.83 | CAPN1 (0.50) | CAPN1CTSBCTSSCTSKCTSL | |
| Hydrochloric Acid SCHEMBL7787786 | 0.83 | CAPN1 (0.50) | CAPN1CTSBCTSSCTSKCTSL | |
| SCHEMBL1333615 | 0.79 | CAPN1 (0.53) | CAPN1CTSBCTSSCTSKCTSL | |
| SCHEMBL1333613 | 0.79 | CAPN1 (0.53) | CAPN1CTSBCTSSCTSKCTSL | |
| SCHEMBL7376391 | 0.78 | CAPN1 (0.49) | CAPN1CTSBCTSKCTSL | |
| Hydrochloric Acid SCHEMBL7789983 | 0.77 | CAPN1 (0.48) | CAPN1CTSBCTSKCTSL | |
| Hydrochloric Acid SCHEMBL7789980 | 0.77 | CAPN1 (0.48) | CAPN1CTSBCTSKCTSL |
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 3 patents. 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 |
| EP-0944584-A1 | BENZAMIDOALDEHYDES AND THEIR USE AS CYSTEINE PROTEASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1999-09-29 | — | — | EP | disclosed |
| WO-1998023581-A1 | BENZAMIDOALDEHYDES AND THEIR USE AS CYSTEINE PROTEASE INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 1998-06-04 | — | — | WO | disclosed |