Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.48 |
| ▸ | CES1 | P23141 | 2/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.37 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23780939 | 0.86 | FURIN (0.38) | CES2CES1PARP1HDAC6NPC1 | |
| SCHEMBL11327171 | 0.78 | HTT (0.47) | PARP1NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL11313782 | 0.75 | CES2 (0.41) | CES2CES1PTGS1PTGS2ACHE | |
| SCHEMBL6890595 | 0.74 | CES2 (0.41) | CES2CES1LMNAALDH1A1 | |
| SCHEMBL8761571 | 0.74 | CES2 (0.60) | CES2CES1PARP1PTGS1PTGS2 | |
| SCHEMBL16955426 | 0.73 | CES2 (0.58) | CES2CES1PARP1PTGS1PTGS2 | |
| SCHEMBL6862739 | 0.71 | CES2 (0.56) | CES2CES1PARP1PTGS1PTGS2 | |
| SCHEMBL12444117 | 0.71 | CES2 (0.68) | CES2CES1PARP1HDAC1HDAC6 | |
| SCHEMBL28879839 | 0.71 | CES2 (0.56) | CES2CES1PARP1PTGS1PTGS2 | |
| SCHEMBL69483 | 0.71 | CES2 (0.68) | CES2CES1PARP1HDAC1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4264336-A | FOR IMPROVING THE OCTANE QUALITY OF UNLEADED GASOLINE | PHILLIPS PETROLEUM COMPANY (US) | 1981-04-28 | — | — | US | disclosed |