Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 9/20 | 0.38 |
| ▸ | TP53 | P04637 | 6/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23611372 | 1.00 | MAPT (0.38) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL23611448 | 0.93 | CLK1 (0.37) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL30060447 | 0.93 | CLK1 (0.37) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL30060445 | 0.89 | MAPT (0.44) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL23611386 | 0.89 | MAPT (0.44) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL23611335 | 0.88 | VNN1 (0.35) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL30060452 | 0.88 | VNN1 (0.35) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL23611312 | 0.85 | CYP2C9 (0.39) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL30060466 | 0.85 | CYP2C9 (0.39) | MAPTTP53ADORA2ATDP1SMN1; SMN2 | |
| SCHEMBL23611347 | 0.85 | VNN1 (0.35) | MAPTTP53ADORA2ATDP1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4085057-A1 | NOVEL PQSR INVERSE AGONISTS | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2022-11-09 | — | — | EP | disclosed |