Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 10/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | PRNP | P04156 | 2/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7789879 | 1.00 | CAPN1 (0.48) | CAPN1RAB9APRNPRXFP1KDM4E | |
| SCHEMBL7786986 | 0.87 | KCNK2 (0.44) | RAB9APRNPRXFP1KDM4EKCNK2 | |
| SCHEMBL7787801 | 0.83 | CAPN1 (0.58) | CAPN1KDM4E | |
| SCHEMBL7787804 | 0.83 | CAPN1 (0.58) | CAPN1KDM4E | |
| SCHEMBL11189080 | 0.78 | RXFP1 (0.60) | RAB9APRNPRXFP1KDM4EKCNK2 | |
| SCHEMBL7378642 | 0.76 | CAPN1 (0.74) | CAPN1HPGD | |
| SCHEMBL40781 | 0.76 | CAPN1 (0.74) | CAPN1HPGD | |
| SCHEMBL29177611 | 0.75 | RXFP1 (0.60) | RAB9APRNPRXFP1KDM4EMAPK10 | |
| SCHEMBL24862936 | 0.74 | CAPN1 (0.63) | CAPN1 | |
| SCHEMBL7451101 | 0.74 | CAPN1 (0.63) | CAPN1RAB9ANPC1 |
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 |