Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 2/20 | 0.54 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 3/20 | 0.50 |
| ▸ | BACE2 | Q9Y5Z0 | 3/20 | 0.50 |
| ▸ | CASP3 | P42574 | 7/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | CASP6 | P55212 | 6/20 | 0.46 |
| ▸ | CASP8 | Q14790 | 6/20 | 0.46 |
| ▸ | REN | P00797 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29802526 | 1.00 | CASP1 (0.54) | CASP1OPRD1BACE1BACE2CASP3 | |
| SCHEMBL5138553 | 0.93 | CASP1 (0.54) | CASP1OPRD1BACE1BACE2CASP3 | |
| SCHEMBL7403480 | 0.90 | CASP1 (0.55) | CASP1OPRD1BACE1BACE2CASP3 | |
| SCHEMBL29293974 | 0.89 | CASP3 (0.51) | OPRD1CASP3CASP6CASP8 | |
| SCHEMBL24850387 | 0.89 | CASP3 (0.51) | OPRD1CASP3CASP6CASP8 | |
| SCHEMBL7328489 | 0.84 | CASP1 (0.58) | CASP1OPRD1BACE1BACE2CASP3 | |
| SCHEMBL7364542 | 0.83 | CASP3 (0.53) | CASP1CASP3CASP7CASP6CASP8 | |
| SCHEMBL12946447 | 0.82 | CASP1 (0.54) | CASP1OPRD1BACE1BACE2CASP3 | |
| SCHEMBL8401660 | 0.82 | CASP1 (0.54) | CASP1OPRD1BACE1BACE2CASP3 | |
| SCHEMBL949276 | 0.82 | CASP1 (0.54) | CASP1OPRD1BACE1BACE2CASP3 |
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-2022190064-A1 | METHODS FOR IDENTIFYING SUBJECTS WITH BETACORONAVIRUS INFECTIONS WHO ARE AT RISK OF ACUTE RESPIRATORY SYNDROME AND METHODS FOR THE TREATMENT OF SAME | VEXO PHARMACEUTICALS DMCC (AE) | 2022-09-15 | — | — | WO | disclosed |