Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 8/20 | 0.75 |
| ▸ | CTRB1 | P17538 | 5/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CTRC | Q99895 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7374424 | 1.00 | CAPN1 (0.75) | CAPN1CTRB1RAB9AALDH1A1CTRC | |
| SCHEMBL40781 | 0.94 | CAPN1 (0.74) | CAPN1CTRB1CTRC | |
| SCHEMBL7378642 | 0.94 | CAPN1 (0.74) | CAPN1CTRB1CTRC | |
| SCHEMBL7377358 | 0.90 | CAPN1 (0.70) | CAPN1CTRB1 | |
| SCHEMBL7786975 | 0.90 | CAPN1 (0.70) | CAPN1CTRB1 | |
| SCHEMBL7451101 | 0.88 | CAPN1 (0.63) | CAPN1RAB9ANPC1 | |
| SCHEMBL7376183 | 0.86 | CAPN1 (1.00) | CAPN1 | |
| SCHEMBL7787032 | 0.86 | CAPN1 (1.00) | CAPN1 | |
| SCHEMBL24862936 | 0.85 | CAPN1 (0.63) | CAPN1CTRB1CTRC | |
| SCHEMBL7791361 | 0.82 | ROCK1 (0.67) | CAPN1CTRC |
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 |