Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | MPO | P05164 | 5/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | GLS | O94925 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | DAO | P14920 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27644456 | 0.85 | PARP1 (0.68) | PARP1ALDH1A1GAAMAPTGLS | |
| SCHEMBL13322432 | 0.84 | IAPP (0.54) | PARP1ALDH1A1GAAMAPTGLS | |
| SCHEMBL29777099 | 0.83 | GAA (0.54) | PARP1ALDH1A1GAAMAPTGLS | |
| SCHEMBL14987599 | 0.83 | GAA (0.54) | PARP1ALDH1A1GAAMAPTGLS | |
| SCHEMBL10672517 | 0.80 | CDK4 (0.49) | PARP1ALDH1A1GAAMAPTGLS | |
| SCHEMBL2036741 | 0.80 | MAPT (0.49) | PARP1MTNR1AALDH1A1GAAMAPT | |
| SCHEMBL10970223 | 0.79 | PARP1 (0.56) | PARP1ALDH1A1GLSEGFRMAPK1 | |
| SCHEMBL27596906 | 0.79 | ROCK2 (0.49) | PARP1MTNR1AMAPTGLSMAPK1 | |
| SCHEMBL664283 | 0.79 | MAPT (0.70) | MPOALDH1A1GAAMAPT | |
| SCHEMBL10759700 | 0.78 | PARP1 (0.55) | PARP1MAPTGLSHDAC1HDAC2 |
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-0997474-A1 | Antithrombotic agents | PFIZER INC. (US) | 2000-05-03 | — | — | EP | disclosed |