Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 4/20 | 0.37 |
| ▸ | GRPR | P30550 | 3/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.35 |
| ▸ | PLK1 | P53350 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | REN | P00797 | 1/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22817289 | 1.00 | CASP1 (0.40) | CASP1BACE1BACE2HRH1GRPR | |
| SCHEMBL22817333 | 0.97 | CASP1 (0.39) | CASP1BACE1BACE2HRH1GRPR | |
| SCHEMBL11317719 | 0.86 | F2 (0.41) | PLK1REN | |
| SCHEMBL11317714 | 0.86 | F2 (0.41) | PLK1REN | |
| SCHEMBL8156095 | 0.83 | CASP1 (0.35) | CASP1BACE1BACE2HRH1GRPR | |
| SCHEMBL22875706 | 0.82 | CASP1 (0.37) | CASP1BACE1BACE2 | |
| SCHEMBL31207720 | 0.82 | TFPI (0.54) | — | |
| SCHEMBL29460678 | 0.82 | TFPI (0.54) | — | |
| SCHEMBL31746072 | 0.81 | PTPN1 (0.49) | BACE1BACE2GRPRSIRT5PTPN1 | |
| SCHEMBL30193475 | 0.81 | BACE1 (0.41) | BACE1BACE2CTSD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020257745-A1 | COMPOSITIONS AND METHODS USEFUL IN TREATING BRAIN DISEASES | UNIVERSITY OF KANSAS (US) | 2020-12-24 | — | — | WO | disclosed |