Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 9/20 | 0.60 |
| ▸ | BCL2 | P10415 | 1/20 | 0.50 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.50 |
| ▸ | SLC16A3 | O15427 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KCNA5 | P22460 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7384115 | 1.00 | CAPN1 (0.60) | CAPN1BCL2BCL2L1MCL1BCL2A1 | |
| SCHEMBL6799602 | 0.86 | CAPN1 (0.56) | CAPN1BCL2BCL2L1MCL1BCL2A1 | |
| SCHEMBL6799603 | 0.86 | CAPN1 (0.56) | CAPN1BCL2BCL2L1MCL1BCL2A1 | |
| SCHEMBL7786988 | 0.84 | BCL2 (0.51) | BCL2BCL2L1MCL1BCL2A1SLC16A3 | |
| SCHEMBL7786990 | 0.84 | BCL2 (0.51) | BCL2BCL2L1MCL1BCL2A1SLC16A3 | |
| SCHEMBL7787808 | 0.84 | ALDH1A1 (0.56) | CAPN1SLC16A3 | |
| SCHEMBL7787807 | 0.84 | ALDH1A1 (0.56) | CAPN1SLC16A3 | |
| SCHEMBL7790018 | 0.84 | CAPN1 (0.53) | CAPN1 | |
| SCHEMBL7789803 | 0.84 | CAPN1 (0.48) | CAPN1BCL2BCL2L1MCL1BCL2A1 | |
| SCHEMBL7789807 | 0.84 | CAPN1 (0.48) | CAPN1BCL2BCL2L1MCL1BCL2A1 |
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 |