Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.45 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.45 |
| ▸ | PPARG | P37231 | 6/20 | 0.44 |
| ▸ | PPARA | Q07869 | 2/20 | 0.44 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28036337 | 0.95 | CYSLTR2 (0.50) | CYP1A2CYP2C9CYP2C19L3MBTL1GAA | |
| SCHEMBL28036403 | 0.94 | CYSLTR2 (0.52) | CYP1A2CYP2C9CYP2C19L3MBTL1GAA | |
| SCHEMBL10512418 | 0.81 | CYP1A2 (0.53) | CYP1A2CYP2C9CYP2C19L3MBTL1CYSLTR2 | |
| SCHEMBL8733422 | 0.81 | CYP1A2 (0.53) | CYP1A2CYP2C9CYP2C19L3MBTL1TDP1 | |
| SCHEMBL9226775 | 0.81 | L3MBTL1 (0.58) | CYP1A2CYP2C9CYP2C19L3MBTL1CYSLTR2 | |
| SCHEMBL27842200 | 0.80 | HTR2C (0.39) | GAALMNAALDH1A1KMT2AMEN1 | |
| SCHEMBL10535862 | 0.79 | CYSLTR2 (0.50) | CYP1A2CYP2C9CYP2C19L3MBTL1GAA | |
| SCHEMBL3210766 | 0.77 | CYP1A2 (0.49) | CYP1A2CYP2C9CYP2C19L3MBTL1CYSLTR2 | |
| SCHEMBL27833449 | 0.77 | TDP1 (0.50) | CYP1A2CYP2C9CYP2C19L3MBTL1GAA | |
| SCHEMBL11734033 | 0.77 | CYSLTR2 (0.51) | CYP1A2CYP2C9CYP2C19L3MBTL1GAA |
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-0251082-A2 | Substituted acrylic acid esters and fungicides containing these compounds | BASF Aktiengesellschaft (DE) | 1988-01-07 | — | — | EP | disclosed |