Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 6/20 | 0.39 |
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.33 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22778017 | 1.00 | PTGS2 (0.43) | PTGS2ERN1NFE2L2CES2CES1 | |
| SCHEMBL1905225 | 0.83 | CES2 (0.36) | CES2CES1 | |
| SCHEMBL19716210 | 0.79 | NFE2L2 (0.45) | ERN1NFE2L2CES2CES1 | |
| SCHEMBL19716211 | 0.79 | NFE2L2 (0.45) | ERN1NFE2L2CES2CES1 | |
| SCHEMBL3569619 | 0.73 | PTGS2 (0.56) | PTGS2ERN1NFE2L2CES2CES1 | |
| SCHEMBL3569615 | 0.73 | PTGS2 (0.56) | PTGS2ERN1NFE2L2CES2CES1 | |
| SCHEMBL1339824 | 0.72 | PTGS2 (0.55) | PTGS2CES2CES1BCHEMAOB | |
| SCHEMBL1339826 | 0.72 | PTGS2 (0.55) | PTGS2CES2CES1BCHEMAOB | |
| SCHEMBL8821192 | 0.71 | NFE2L2 (0.76) | PTGS2NFE2L2MAOB | |
| SCHEMBL16934076 | 0.71 | NFE2L2 (0.43) | PTGS2ERN1NFE2L2CES2CES1 |
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-2020252075-A1 | LIGAND-EXCHANGEABLE JANUS NANOPARTICLES AND METHODS OF MAKING THE SAME | ALLIANCE FOR SUSTAINABLE ENERGY, LLC (US) | 2020-12-17 | — | — | WO | disclosed |