Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9852632 | 1.00 | CES2 (0.36) | CES2CES1NAAAMGLLHDAC8 | |
| SCHEMBL16537470 | 0.77 | CES2 (0.32) | CES2CES1 | |
| SCHEMBL7919284 | 0.76 | CES2 (0.33) | CES2CES1MGLLTSHRALDH1A1 | |
| SCHEMBL18891739 | 0.75 | NOS2 (0.40) | CES2CES1 | |
| SCHEMBL4866423 | 0.71 | CES2 (0.33) | CES2CES1NAAAMGLLHSD11B1 | |
| SCHEMBL4866431 | 0.71 | CES2 (0.33) | CES2CES1NAAAMGLLHSD11B1 | |
| SCHEMBL4866439 | 0.71 | CES2 (0.33) | CES2CES1NAAAMGLLHSD11B1 | |
| SCHEMBL4453955 | 0.67 | — | — | |
| SCHEMBL29393374 | 0.67 | NAAA (0.33) | CES2CES1NAAACYP1A2HSD11B1 | |
| SCHEMBL28053088 | 0.67 | NAAA (0.33) | CES2CES1NAAACYP1A2HSD11B1 |
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-0429287-A2 | Anti-inflammatory furanone compounds | ALLERGAN, INC. (US) | 1991-05-29 | — | — | EP | disclosed |