Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.59 |
| ▸ | PLK4 | O00444 | 1/20 | 0.54 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.54 |
| ▸ | AURKA | O14965 | 1/20 | 0.54 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.54 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.54 |
| ▸ | CSF1R | P07333 | 1/20 | 0.54 |
| ▸ | RET | P07949 | 1/20 | 0.54 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.54 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.54 |
| ▸ | LTK | P29376 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.54 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.54 |
| ▸ | FLT3 | P36888 | 1/20 | 0.54 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.54 |
| ▸ | PRKX | P51817 | 1/20 | 0.54 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.54 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.54 |
| ▸ | MST1R | Q04912 | 1/20 | 0.54 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL28917070 | 0.88 | CDK2 (0.56) | PTGESPLK4CHEK1AURKADAPK3 | |
| SCHEMBL23185459 | 0.86 | PLK4 (0.50) | PTGESPLK4CHEK1AURKADAPK3 | |
| SCHEMBL15546999 | 0.83 | PTGES (0.50) | PTGESALDH1A1NPC1KDM4ERAB9A | |
| SCHEMBL15535597 | 0.83 | PTGES (0.50) | PTGESALDH1A1NPC1KDM4ERAB9A | |
| SCHEMBL8354859 | 0.82 | PARP1 (0.48) | PTGESPLK4CHEK1AURKADAPK3 | |
| SCHEMBL8359202 | 0.82 | PARP1 (0.48) | PTGESPLK4CHEK1AURKADAPK3 | |
| SCHEMBL28721012 | 0.82 | PTGES (0.48) | PTGESALDH1A1NPC1KDM4ERAB9A | |
| SCHEMBL14391753 | 0.81 | TDO2 (0.51) | PTGESPLK4CHEK1AURKADAPK3 | |
| SCHEMBL26432903 | 0.79 | PLK4 (0.48) | PLK4CHEK1AURKADAPK3MAP4K4 | |
| SCHEMBL26414255 | 0.78 | MEN1 (0.48) | PTGESALDH1A1NPC1KDM4ERAB9A |
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-1651640-B1 | NICOTINAMIDE DERIVATIVES USEFUL AS PDE4 INHIBITORS | PFIZER LTD (GB) | 2007-02-14 | — | — | EP | disclosed |