Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 6/20 | 0.72 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.50 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.49 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.48 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.47 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.47 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.46 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | FNTA | P49354 | 1/20 | 0.46 |
| ▸ | FNTB | P49356 | 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 | |
|---|---|---|---|---|
| SCHEMBL7789862 | 1.00 | CAPN1 (0.72) | CAPN1MAPTNPC1RAB9AMAOB | |
| SCHEMBL7791324 | 0.84 | CAPN1 (1.00) | CAPN1MAPTNPC1MAOBALDH1A1 | |
| SCHEMBL7791328 | 0.84 | CAPN1 (1.00) | CAPN1MAPTNPC1MAOBALDH1A1 | |
| SCHEMBL7789811 | 0.83 | PIN1 (0.55) | CAPN1MAPTNPC1MAOBPTPN1 | |
| SCHEMBL7789810 | 0.83 | PIN1 (0.55) | CAPN1MAPTNPC1MAOBPTPN1 | |
| SCHEMBL7787044 | 0.82 | CAPN1 (0.57) | CAPN1MAPTNPC1PIN1 | |
| SCHEMBL7789993 | 0.81 | NR1H4 (0.62) | CAPN1PIN1 | |
| SCHEMBL7790056 | 0.81 | CAPN1 (0.74) | CAPN1PIN1 | |
| SCHEMBL7787801 | 0.80 | CAPN1 (0.58) | CAPN1PIN1 | |
| SCHEMBL7787804 | 0.80 | CAPN1 (0.58) | 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 |