Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH2 | P05091 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 7/20 | 0.30 |
| ▸ | MMP3 | P08254 | 6/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | HTR1A | P08908 | 2/20 | 0.30 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.30 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.30 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.30 |
| ▸ | LTA4H | P09960 | 1/20 | 0.30 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.30 |
| ▸ | MMP1 | P03956 | 3/20 | 0.30 |
| ▸ | MMP7 | P09237 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL9766905 | 0.85 | GPR84 (0.31) | LTB4RGPR84 | |
| SCHEMBL9766937 | 0.83 | — | — | |
| SCHEMBL9766947 | 0.78 | GPR84 (0.42) | MMP2LTB4RGPR84 | |
| SCHEMBL9767101 | 0.76 | FAAH (0.37) | CYP1A2 | |
| SCHEMBL9766991 | 0.74 | F10 (0.37) | ALDH2 | |
| SCHEMBL9767150 | 0.68 | GPR84 (0.31) | GPR84CA2 | |
| SCHEMBL9325034 | 0.67 | GLS2 (0.35) | LTB4RLTA4H | |
| SCHEMBL7295059 | 0.67 | GLS2 (0.35) | LTB4RLTA4H | |
| SCHEMBL9325177 | 0.67 | ALDH1A1 (0.39) | LTB4R | |
| SCHEMBL9670950 | 0.67 | GLS2 (0.35) | LTB4RLTA4H |
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-5013850-A | 4-ethyl and 4-ethenyl-5-hydroxy-2(5H)-furanones substituted on alpha carbon of the ethyl or ethenyl side chain with a long chain alkyl group and on the beta carbon with a polar group, as anti-inflammatory agents | ALLERGAN, INC. (US) | 1991-05-07 | — | — | US | disclosed |